Benzenoids
Benzenoids
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Sodium Salicylate, 99%, Thermo Scientific Chemicals
CAS: 54-21-7 Molecular Formula: C7H5NaO3 Molecular Weight (g/mol): 160.104 MDL Number: MFCD00002440 InChI Key: ABBQHOQBGMUPJH-UHFFFAOYSA-M Synonym: sodium salicylate,sodium 2-hydroxybenzoate,salsonin,clin,enterosalicyl,enterosalil,entrosalyl,glutosalyl,kerasalicyl,magsalyl PubChem CID: 16760658 ChEBI: CHEBI:9180 IUPAC Name: sodium;2-hydroxybenzoate SMILES: C1=CC=C(C(=C1)C(=O)[O-])O.[Na+]
PubChem CID | 16760658 |
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CAS | 54-21-7 |
Molecular Weight (g/mol) | 160.104 |
ChEBI | CHEBI:9180 |
MDL Number | MFCD00002440 |
SMILES | C1=CC=C(C(=C1)C(=O)[O-])O.[Na+] |
Synonym | sodium salicylate,sodium 2-hydroxybenzoate,salsonin,clin,enterosalicyl,enterosalil,entrosalyl,glutosalyl,kerasalicyl,magsalyl |
IUPAC Name | sodium;2-hydroxybenzoate |
InChI Key | ABBQHOQBGMUPJH-UHFFFAOYSA-M |
Molecular Formula | C7H5NaO3 |
Acetylsalicylic acid, 99%, Thermo Scientific Chemicals
CAS: 50-78-2 Molecular Formula: C9H8O4 Molecular Weight (g/mol): 180.16 MDL Number: MFCD00002430 InChI Key: BSYNRYMUTXBXSQ-UHFFFAOYSA-N Synonym: aspirin,acetylsalicylic acid,2-acetoxybenzoic acid,2-acetyloxy benzoic acid,acetylsalicylate,o-acetylsalicylic acid,o-acetoxybenzoic acid,acylpyrin,polopiryna,easprin PubChem CID: 2244 ChEBI: CHEBI:15365 IUPAC Name: 2-acetyloxybenzoic acid SMILES: CC(=O)OC1=CC=CC=C1C(O)=O
PubChem CID | 2244 |
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CAS | 50-78-2 |
Molecular Weight (g/mol) | 180.16 |
ChEBI | CHEBI:15365 |
MDL Number | MFCD00002430 |
SMILES | CC(=O)OC1=CC=CC=C1C(O)=O |
Synonym | aspirin,acetylsalicylic acid,2-acetoxybenzoic acid,2-acetyloxy benzoic acid,acetylsalicylate,o-acetylsalicylic acid,o-acetoxybenzoic acid,acylpyrin,polopiryna,easprin |
IUPAC Name | 2-acetyloxybenzoic acid |
InChI Key | BSYNRYMUTXBXSQ-UHFFFAOYSA-N |
Molecular Formula | C9H8O4 |
Sodium Salicylate (Powder/Certified), Fisher Chemical
CAS: 54-21-7 Molecular Formula: C7H5NaO3 Molecular Weight (g/mol): 160.104 MDL Number: MFCD00002440 InChI Key: ABBQHOQBGMUPJH-UHFFFAOYSA-M Synonym: sodium salicylate,sodium 2-hydroxybenzoate,salsonin,clin,enterosalicyl,enterosalil,entrosalyl,glutosalyl,kerasalicyl,magsalyl PubChem CID: 16760658 ChEBI: CHEBI:9180 IUPAC Name: sodium;2-hydroxybenzoate SMILES: C1=CC=C(C(=C1)C(=O)[O-])O.[Na+]
PubChem CID | 16760658 |
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CAS | 54-21-7 |
Molecular Weight (g/mol) | 160.104 |
ChEBI | CHEBI:9180 |
MDL Number | MFCD00002440 |
SMILES | C1=CC=C(C(=C1)C(=O)[O-])O.[Na+] |
Synonym | sodium salicylate,sodium 2-hydroxybenzoate,salsonin,clin,enterosalicyl,enterosalil,entrosalyl,glutosalyl,kerasalicyl,magsalyl |
IUPAC Name | sodium;2-hydroxybenzoate |
InChI Key | ABBQHOQBGMUPJH-UHFFFAOYSA-M |
Molecular Formula | C7H5NaO3 |
4'-Hydroxyacetanilide 98.0+%, TCI America™
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CAS: 103-90-2 Molecular Formula: C8H9NO2 Molecular Weight (g/mol): 151.17 MDL Number: MFCD00002328 InChI Key: RZVAJINKPMORJF-UHFFFAOYSA-N Synonym: acetaminophen,4-acetamidophenol,paracetamol,apap,n-4-hydroxyphenyl acetamide,tylenol,acetaminofen,panadol,datril,p-acetamidophenol PubChem CID: 1983 ChEBI: CHEBI:46195 IUPAC Name: N-(4-hydroxyphenyl)acetamide SMILES: CC(=O)NC1=CC=C(O)C=C1
PubChem CID | 1983 |
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CAS | 103-90-2 |
Molecular Weight (g/mol) | 151.17 |
ChEBI | CHEBI:46195 |
MDL Number | MFCD00002328 |
SMILES | CC(=O)NC1=CC=C(O)C=C1 |
Synonym | acetaminophen,4-acetamidophenol,paracetamol,apap,n-4-hydroxyphenyl acetamide,tylenol,acetaminofen,panadol,datril,p-acetamidophenol |
IUPAC Name | N-(4-hydroxyphenyl)acetamide |
InChI Key | RZVAJINKPMORJF-UHFFFAOYSA-N |
Molecular Formula | C8H9NO2 |
Phthaldialdehyde, 98%, Thermo Scientific Chemicals
CAS: 643-79-8 Molecular Formula: C8H6O2 Molecular Weight (g/mol): 134.13 MDL Number: MFCD00003335 InChI Key: ZWLUXSQADUDCSB-UHFFFAOYSA-N Synonym: o-phthalaldehyde,o-phthaldialdehyde,benzene-1,2-dicarboxaldehyde,1,2-benzenedicarboxaldehyde,phthaldialdehyde,phthalic aldehyde,phthalic dialdehyde,phthalyldicarboxaldehyde,ortho-phthalaldehyde,o-phthaldehyde PubChem CID: 4807 ChEBI: CHEBI:70851 IUPAC Name: phthalaldehyde SMILES: O=CC1=CC=CC=C1C=O
PubChem CID | 4807 |
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CAS | 643-79-8 |
Molecular Weight (g/mol) | 134.13 |
ChEBI | CHEBI:70851 |
MDL Number | MFCD00003335 |
SMILES | O=CC1=CC=CC=C1C=O |
Synonym | o-phthalaldehyde,o-phthaldialdehyde,benzene-1,2-dicarboxaldehyde,1,2-benzenedicarboxaldehyde,phthaldialdehyde,phthalic aldehyde,phthalic dialdehyde,phthalyldicarboxaldehyde,ortho-phthalaldehyde,o-phthaldehyde |
IUPAC Name | phthalaldehyde |
InChI Key | ZWLUXSQADUDCSB-UHFFFAOYSA-N |
Molecular Formula | C8H6O2 |
XTT sodium salt, Thermo Scientific Chemicals
CAS: 111072-31-2 Molecular Formula: C22H16N7NaO13S2 Molecular Weight (g/mol): 673.52 MDL Number: MFCD00083517 InChI Key: JACYMBNQPPWQML-UHFFFAOYSA-M Synonym: xtt PubChem CID: 131668615 IUPAC Name: sodium;2-(2-methoxy-4-nitro-5-sulfonatophenyl)-3-(2-methoxy-4-nitro-5-sulfophenyl)-N-phenyltetrazol-3-ium-5-carboximidate SMILES: [Na+].COC1=C(C=C(C(=C1)[N+]([O-])=O)S([O-])(=O)=O)N1N=C(N=[N+]1C1=C(OC)C=C(C(=C1)S([O-])(=O)=O)[N+]([O-])=O)C(=O)NC1=CC=CC=C1
PubChem CID | 131668615 |
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CAS | 111072-31-2 |
Molecular Weight (g/mol) | 673.52 |
MDL Number | MFCD00083517 |
SMILES | [Na+].COC1=C(C=C(C(=C1)[N+]([O-])=O)S([O-])(=O)=O)N1N=C(N=[N+]1C1=C(OC)C=C(C(=C1)S([O-])(=O)=O)[N+]([O-])=O)C(=O)NC1=CC=CC=C1 |
Synonym | xtt |
IUPAC Name | sodium;2-(2-methoxy-4-nitro-5-sulfonatophenyl)-3-(2-methoxy-4-nitro-5-sulfophenyl)-N-phenyltetrazol-3-ium-5-carboximidate |
InChI Key | JACYMBNQPPWQML-UHFFFAOYSA-M |
Molecular Formula | C22H16N7NaO13S2 |
Salicylic acid, sodium salt, 99+%, Thermo Scientific Chemicals
CAS: 54-21-7 Molecular Formula: C7H5NaO3 Molecular Weight (g/mol): 160.104 MDL Number: MFCD00002440 InChI Key: ABBQHOQBGMUPJH-UHFFFAOYSA-M Synonym: sodium salicylate,sodium 2-hydroxybenzoate,salsonin,clin,enterosalicyl,enterosalil,entrosalyl,glutosalyl,kerasalicyl,magsalyl PubChem CID: 16760658 ChEBI: CHEBI:9180 IUPAC Name: sodium;2-hydroxybenzoate SMILES: C1=CC=C(C(=C1)C(=O)[O-])O.[Na+]
PubChem CID | 16760658 |
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CAS | 54-21-7 |
Molecular Weight (g/mol) | 160.104 |
ChEBI | CHEBI:9180 |
MDL Number | MFCD00002440 |
SMILES | C1=CC=C(C(=C1)C(=O)[O-])O.[Na+] |
Synonym | sodium salicylate,sodium 2-hydroxybenzoate,salsonin,clin,enterosalicyl,enterosalil,entrosalyl,glutosalyl,kerasalicyl,magsalyl |
IUPAC Name | sodium;2-hydroxybenzoate |
InChI Key | ABBQHOQBGMUPJH-UHFFFAOYSA-M |
Molecular Formula | C7H5NaO3 |
Tetrakis(triphenylphosphine)palladium(0), 99%, Thermo Scientific Chemicals
CAS: 14221-01-3 Molecular Formula: C72H60P4Pd Molecular Weight (g/mol): 1155.59 MDL Number: MFCD00010012 InChI Key: NFHFRUOZVGFOOS-UHFFFAOYSA-N Synonym: tetrakis triphenylphosphine palladium,tetrakis triphenylphosphine palladium 0,pd pph3 4,tetrakis triphenylphosphine palladium o,tetra triphenylphosphine palladium,palladium-tetrakis triphenylphosphine,palladium 0 tetrakis triphenylphosphine,palladium, tetrakis triphenylphosphine-, t-4 PubChem CID: 11979704 IUPAC Name: palladium;triphenylphosphane SMILES: [Pd].C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1
PubChem CID | 11979704 |
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CAS | 14221-01-3 |
Molecular Weight (g/mol) | 1155.59 |
MDL Number | MFCD00010012 |
SMILES | [Pd].C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1.C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC=C1 |
Synonym | tetrakis triphenylphosphine palladium,tetrakis triphenylphosphine palladium 0,pd pph3 4,tetrakis triphenylphosphine palladium o,tetra triphenylphosphine palladium,palladium-tetrakis triphenylphosphine,palladium 0 tetrakis triphenylphosphine,palladium, tetrakis triphenylphosphine-, t-4 |
IUPAC Name | palladium;triphenylphosphane |
InChI Key | NFHFRUOZVGFOOS-UHFFFAOYSA-N |
Molecular Formula | C72H60P4Pd |
Phenol (Liquid/Certified ACS), Fisher Chemical™
CAS: 108-95-2 Molecular Formula: C6H6O Molecular Weight (g/mol): 94.11 MDL Number: MFCD00002143 InChI Key: ISWSIDIOOBJBQZ-UHFFFAOYSA-N Synonym: carbolic acid,hydroxybenzene,phenic acid,phenylic acid,oxybenzene,benzenol,phenyl hydrate,monophenol,phenyl hydroxide,phenylic alcohol PubChem CID: 996 ChEBI: CHEBI:15882 IUPAC Name: phenol SMILES: OC1=CC=CC=C1
PubChem CID | 996 |
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CAS | 108-95-2 |
Molecular Weight (g/mol) | 94.11 |
ChEBI | CHEBI:15882 |
MDL Number | MFCD00002143 |
SMILES | OC1=CC=CC=C1 |
Synonym | carbolic acid,hydroxybenzene,phenic acid,phenylic acid,oxybenzene,benzenol,phenyl hydrate,monophenol,phenyl hydroxide,phenylic alcohol |
IUPAC Name | phenol |
InChI Key | ISWSIDIOOBJBQZ-UHFFFAOYSA-N |
Molecular Formula | C6H6O |
p-Anisaldehyde 99.0+%, TCI America™
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CAS: 123-11-5 Molecular Formula: C8H8O2 Molecular Weight (g/mol): 136.15 MDL Number: MFCD00003385 InChI Key: ZRSNZINYAWTAHE-UHFFFAOYSA-N Synonym: p-anisaldehyde,anisaldehyde,anisic aldehyde,p-methoxybenzaldehyde,4-anisaldehyde,aubepine,p-anisic aldehyde,p-formylanisole,benzaldehyde, 4-methoxy,crategine PubChem CID: 31244 ChEBI: CHEBI:28235 IUPAC Name: 4-methoxybenzaldehyde SMILES: COC1=CC=C(C=C1)C=O
PubChem CID | 31244 |
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CAS | 123-11-5 |
Molecular Weight (g/mol) | 136.15 |
ChEBI | CHEBI:28235 |
MDL Number | MFCD00003385 |
SMILES | COC1=CC=C(C=C1)C=O |
Synonym | p-anisaldehyde,anisaldehyde,anisic aldehyde,p-methoxybenzaldehyde,4-anisaldehyde,aubepine,p-anisic aldehyde,p-formylanisole,benzaldehyde, 4-methoxy,crategine |
IUPAC Name | 4-methoxybenzaldehyde |
InChI Key | ZRSNZINYAWTAHE-UHFFFAOYSA-N |
Molecular Formula | C8H8O2 |
Hydroquinone, 99%, Thermo Scientific Chemicals
CAS: 123-31-9 Molecular Formula: C6H6O2 Molecular Weight (g/mol): 110.112 MDL Number: MFCD00002339 InChI Key: QIGBRXMKCJKVMJ-UHFFFAOYSA-N Synonym: hydroquinone,1,4-benzenediol,quinol,1,4-dihydroxybenzene,p-benzenediol,4-hydroxyphenol,p-hydroquinone,p-hydroxyphenol,p-dihydroxybenzene,benzoquinol PubChem CID: 785 ChEBI: CHEBI:17594 IUPAC Name: benzene-1,4-diol SMILES: C1=CC(=CC=C1O)O
PubChem CID | 785 |
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CAS | 123-31-9 |
Molecular Weight (g/mol) | 110.112 |
ChEBI | CHEBI:17594 |
MDL Number | MFCD00002339 |
SMILES | C1=CC(=CC=C1O)O |
Synonym | hydroquinone,1,4-benzenediol,quinol,1,4-dihydroxybenzene,p-benzenediol,4-hydroxyphenol,p-hydroquinone,p-hydroxyphenol,p-dihydroxybenzene,benzoquinol |
IUPAC Name | benzene-1,4-diol |
InChI Key | QIGBRXMKCJKVMJ-UHFFFAOYSA-N |
Molecular Formula | C6H6O2 |
Bromobenzene 99.0+%, TCI America™
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CAS: 108-86-1 Molecular Formula: C6H5Br Molecular Weight (g/mol): 157.01 MDL Number: MFCD00000055 InChI Key: QARVLSVVCXYDNA-UHFFFAOYSA-N Synonym: benzene, bromo,monobromobenzene,phenyl bromide,bromo-benzene,1-bromobenzene,phbr,bromo benzene,4-bromobenzene,unii-co4d5j547l,hsdb 47 PubChem CID: 7961 ChEBI: CHEBI:3179 IUPAC Name: bromobenzene SMILES: BrC1=CC=CC=C1
PubChem CID | 7961 |
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CAS | 108-86-1 |
Molecular Weight (g/mol) | 157.01 |
ChEBI | CHEBI:3179 |
MDL Number | MFCD00000055 |
SMILES | BrC1=CC=CC=C1 |
Synonym | benzene, bromo,monobromobenzene,phenyl bromide,bromo-benzene,1-bromobenzene,phbr,bromo benzene,4-bromobenzene,unii-co4d5j547l,hsdb 47 |
IUPAC Name | bromobenzene |
InChI Key | QARVLSVVCXYDNA-UHFFFAOYSA-N |
Molecular Formula | C6H5Br |
Benzophenone, 99%, Thermo Scientific Chemicals
CAS: 119-61-9 Molecular Formula: C13H10O Molecular Weight (g/mol): 182.222 MDL Number: MFCD00003076 InChI Key: RWCCWEUUXYIKHB-UHFFFAOYSA-N Synonym: benzophenone,diphenyl ketone,benzoylbenzene,phenyl ketone,methanone, diphenyl,alpha-oxoditane,ketone, diphenyl,benzene, benzoyl,alpha-oxodiphenylmethane,diphenylketone PubChem CID: 3102 ChEBI: CHEBI:41308 IUPAC Name: diphenylmethanone SMILES: C1=CC=C(C=C1)C(=O)C2=CC=CC=C2
PubChem CID | 3102 |
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CAS | 119-61-9 |
Molecular Weight (g/mol) | 182.222 |
ChEBI | CHEBI:41308 |
MDL Number | MFCD00003076 |
SMILES | C1=CC=C(C=C1)C(=O)C2=CC=CC=C2 |
Synonym | benzophenone,diphenyl ketone,benzoylbenzene,phenyl ketone,methanone, diphenyl,alpha-oxoditane,ketone, diphenyl,benzene, benzoyl,alpha-oxodiphenylmethane,diphenylketone |
IUPAC Name | diphenylmethanone |
InChI Key | RWCCWEUUXYIKHB-UHFFFAOYSA-N |
Molecular Formula | C13H10O |
p-Toluenesulfonyl Chloride 99.0+%, TCI America™
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CAS: 98-59-9 Molecular Formula: C7H7ClO2S Molecular Weight (g/mol): 190.64 MDL Number: MFCD00007450 InChI Key: YYROPELSRYBVMQ-UHFFFAOYSA-N Synonym: tosyl chloride,p-toluenesulfonyl chloride,p-tosyl chloride,4-toluenesulfonyl chloride,p-toluenesulfochloride,4-methylbenzene-1-sulfonyl chloride,p-tolylsulfonyl chloride,p-toluenesulphonyl chloride,tosylchloride,p-toluenesulfonic acid chloride PubChem CID: 7397 IUPAC Name: 4-methylbenzene-1-sulfonyl chloride SMILES: CC1=CC=C(C=C1)S(Cl)(=O)=O
PubChem CID | 7397 |
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CAS | 98-59-9 |
Molecular Weight (g/mol) | 190.64 |
MDL Number | MFCD00007450 |
SMILES | CC1=CC=C(C=C1)S(Cl)(=O)=O |
Synonym | tosyl chloride,p-toluenesulfonyl chloride,p-tosyl chloride,4-toluenesulfonyl chloride,p-toluenesulfochloride,4-methylbenzene-1-sulfonyl chloride,p-tolylsulfonyl chloride,p-toluenesulphonyl chloride,tosylchloride,p-toluenesulfonic acid chloride |
IUPAC Name | 4-methylbenzene-1-sulfonyl chloride |
InChI Key | YYROPELSRYBVMQ-UHFFFAOYSA-N |
Molecular Formula | C7H7ClO2S |
2,4-Dinitrophenylhydrazine Hydrochloride 98.0+%, TCI America™
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CAS: 55907-61-4 Molecular Formula: C6H7ClN4O4 Molecular Weight (g/mol): 234.60 MDL Number: MFCD00050688 InChI Key: PUYFAZQODQZOFK-UHFFFAOYSA-N PubChem CID: 5463312 IUPAC Name: hydrogen (2,4-dinitrophenyl)hydrazine chloride SMILES: [H+].[Cl-].NNC1=CC=C(C=C1[N+]([O-])=O)[N+]([O-])=O
PubChem CID | 5463312 |
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CAS | 55907-61-4 |
Molecular Weight (g/mol) | 234.60 |
MDL Number | MFCD00050688 |
SMILES | [H+].[Cl-].NNC1=CC=C(C=C1[N+]([O-])=O)[N+]([O-])=O |
IUPAC Name | hydrogen (2,4-dinitrophenyl)hydrazine chloride |
InChI Key | PUYFAZQODQZOFK-UHFFFAOYSA-N |
Molecular Formula | C6H7ClN4O4 |