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Benzene and substituted derivatives

Benzene is an aromatic organic molecule composed of six carbon atoms and six hydrogen atoms that form a ring. Includes substituted derivative compounds.
Hydroxybenzoic Acid Derivatives (14,774)
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7,141 – 7,155 of 57,364 results
7,141

2-Iodo-5-methylaniline 98.0+%, TCI America™

CAS: 13194-69-9 Molecular Formula: C7H8IN Molecular Weight (g/mol): 233.052 MDL Number: MFCD00833395 InChI Key: KXPBTNCFONSVIA-UHFFFAOYSA-N Synonym: 3-Amino-4-iodotoluene PubChem CID: 2736659 IUPAC Name: 2-iodo-5-methylaniline SMILES: CC1=CC(=C(C=C1)I)N

PubChem CID 2736659
CAS 13194-69-9
Molecular Weight (g/mol) 233.052
MDL Number MFCD00833395
SMILES CC1=CC(=C(C=C1)I)N
Synonym 3-Amino-4-iodotoluene
IUPAC Name 2-iodo-5-methylaniline
InChI Key KXPBTNCFONSVIA-UHFFFAOYSA-N
Molecular Formula C7H8IN
7,142

2-(2-Bromophenyl)-4,6-diphenyl-1,3,5-triazine 98.0+%, TCI America™

CAS: 77989-15-2 Molecular Formula: C21H14BrN3 Molecular Weight (g/mol): 388.268 MDL Number: MFCD29047055 InChI Key: MSTJGWCHJCZPEQ-UHFFFAOYSA-N PubChem CID: 12689834 IUPAC Name: 2-(2-bromophenyl)-4,6-diphenyl-1,3,5-triazine SMILES: C1=CC=C(C=C1)C2=NC(=NC(=N2)C3=CC=CC=C3Br)C4=CC=CC=C4

PubChem CID 12689834
CAS 77989-15-2
Molecular Weight (g/mol) 388.268
MDL Number MFCD29047055
SMILES C1=CC=C(C=C1)C2=NC(=NC(=N2)C3=CC=CC=C3Br)C4=CC=CC=C4
IUPAC Name 2-(2-bromophenyl)-4,6-diphenyl-1,3,5-triazine
InChI Key MSTJGWCHJCZPEQ-UHFFFAOYSA-N
Molecular Formula C21H14BrN3
7,143

N-(o-Toluoyl)glycine 98.0+%, TCI America™

CAS: 42013-20-7 Molecular Formula: C10H11NO3 Molecular Weight (g/mol): 193.202 MDL Number: MFCD00050991 InChI Key: YOEBAVRJHRCKRE-UHFFFAOYSA-N Synonym: 2-Methylhippuric Acid, N-(2-Methylbenzoyl)glycine PubChem CID: 91637 ChEBI: CHEBI:68455 IUPAC Name: 2-[(2-methylbenzoyl)amino]acetic acid SMILES: CC1=CC=CC=C1C(=O)NCC(=O)O

PubChem CID 91637
CAS 42013-20-7
Molecular Weight (g/mol) 193.202
ChEBI CHEBI:68455
MDL Number MFCD00050991
SMILES CC1=CC=CC=C1C(=O)NCC(=O)O
Synonym 2-Methylhippuric Acid, N-(2-Methylbenzoyl)glycine
IUPAC Name 2-[(2-methylbenzoyl)amino]acetic acid
InChI Key YOEBAVRJHRCKRE-UHFFFAOYSA-N
Molecular Formula C10H11NO3
7,144

2-Benzyloxy-1,3-propanediol 97.0+%, TCI America™

CAS: 14690-00-7 Molecular Formula: C10H14O3 Molecular Weight (g/mol): 182.219 MDL Number: MFCD00075493 InChI Key: UDIPIOHLDFSMLR-UHFFFAOYSA-N Synonym: 2-O-Benzylglycerol, Glycerol 2-Benzyl Ether PubChem CID: 203567 IUPAC Name: 2-phenylmethoxypropane-1,3-diol SMILES: C1=CC=C(C=C1)COC(CO)CO

PubChem CID 203567
CAS 14690-00-7
Molecular Weight (g/mol) 182.219
MDL Number MFCD00075493
SMILES C1=CC=C(C=C1)COC(CO)CO
Synonym 2-O-Benzylglycerol, Glycerol 2-Benzyl Ether
IUPAC Name 2-phenylmethoxypropane-1,3-diol
InChI Key UDIPIOHLDFSMLR-UHFFFAOYSA-N
Molecular Formula C10H14O3
7,145

4-Propylbenzoic Acid 99.0+%, TCI America™

CAS: 2438-05-3 Molecular Formula: C10H11O2 Molecular Weight (g/mol): 163.20 MDL Number: MFCD00013996 InChI Key: ATZHGRNFEFVDDJ-UHFFFAOYSA-M Synonym: 4-n-propylbenzoic acid,benzoic acid, 4-propyl,4-propyl-benzoic acid,p-n-propyl benzoic acid,p-propylbenzoic acid,unii-3p1v85e45o,4-propylbenzoicacid,p-propyl benzoic acid,4-propylbenzolic acid,pubchem1348 PubChem CID: 137601 IUPAC Name: 4-propylbenzoic acid SMILES: CCCC1=CC=C(C=C1)C(=O)O

PubChem CID 137601
CAS 2438-05-3
Molecular Weight (g/mol) 163.20
MDL Number MFCD00013996
SMILES CCCC1=CC=C(C=C1)C(=O)O
Synonym 4-n-propylbenzoic acid,benzoic acid, 4-propyl,4-propyl-benzoic acid,p-n-propyl benzoic acid,p-propylbenzoic acid,unii-3p1v85e45o,4-propylbenzoicacid,p-propyl benzoic acid,4-propylbenzolic acid,pubchem1348
IUPAC Name 4-propylbenzoic acid
InChI Key ATZHGRNFEFVDDJ-UHFFFAOYSA-M
Molecular Formula C10H11O2
7,146

2,4,6-Trimethylbenzoic Acid 98.0+%, TCI America™

CAS: 480-63-7 Molecular Formula: C10H12O2 Molecular Weight (g/mol): 164.20 MDL Number: MFCD00002481 InChI Key: FFFIRKXTFQCCKJ-UHFFFAOYSA-N Synonym: mesitoic acid,mesitylenecarboxylic acid,beta-isodurylic acid,benzoic acid, 2,4,6-trimethyl,.beta.-isodurylic acid,unii-4pu2hg6787,2-mesitylenecarboxylic acid,2,4,6-trimethyl-benzoic acid,2,6-trimethylbenzoic acid,benzoic acid,4,6-trimethyl PubChem CID: 10194 ChEBI: CHEBI:64830 IUPAC Name: 2,4,6-trimethylbenzoic acid SMILES: CC1=CC(C)=C(C(O)=O)C(C)=C1

PubChem CID 10194
CAS 480-63-7
Molecular Weight (g/mol) 164.20
ChEBI CHEBI:64830
MDL Number MFCD00002481
SMILES CC1=CC(C)=C(C(O)=O)C(C)=C1
Synonym mesitoic acid,mesitylenecarboxylic acid,beta-isodurylic acid,benzoic acid, 2,4,6-trimethyl,.beta.-isodurylic acid,unii-4pu2hg6787,2-mesitylenecarboxylic acid,2,4,6-trimethyl-benzoic acid,2,6-trimethylbenzoic acid,benzoic acid,4,6-trimethyl
IUPAC Name 2,4,6-trimethylbenzoic acid
InChI Key FFFIRKXTFQCCKJ-UHFFFAOYSA-N
Molecular Formula C10H12O2
7,147

4-Chloro-2-methylbenzyl Alcohol 98.0+%, TCI America™

CAS: 129716-11-6 Molecular Formula: C8H9ClO Molecular Weight (g/mol): 156.609 MDL Number: MFCD06201140 InChI Key: AHXBDGJNZJKLNE-UHFFFAOYSA-N Synonym: 4-chloro-2-methylphenyl methanol,4-chloro-2-methylbenzyl alcohol,benzenemethanol, 4-chloro-2-methyl,acmc-20aaxd,4-chloro-2-methylbenzylalcohol,4-chloro-2-methyl-phenyl-methanol PubChem CID: 2757669 IUPAC Name: (4-chloro-2-methylphenyl)methanol SMILES: CC1=C(C=CC(=C1)Cl)CO

PubChem CID 2757669
CAS 129716-11-6
Molecular Weight (g/mol) 156.609
MDL Number MFCD06201140
SMILES CC1=C(C=CC(=C1)Cl)CO
Synonym 4-chloro-2-methylphenyl methanol,4-chloro-2-methylbenzyl alcohol,benzenemethanol, 4-chloro-2-methyl,acmc-20aaxd,4-chloro-2-methylbenzylalcohol,4-chloro-2-methyl-phenyl-methanol
IUPAC Name (4-chloro-2-methylphenyl)methanol
InChI Key AHXBDGJNZJKLNE-UHFFFAOYSA-N
Molecular Formula C8H9ClO
7,148

Dodecyl 4-Hydroxybenzoate 98.0+%, TCI America™

CAS: 2664-60-0 Molecular Formula: C19H30O3 Molecular Weight (g/mol): 306.446 MDL Number: MFCD00016473 InChI Key: BAYSQTBAJQRACX-UHFFFAOYSA-N Synonym: dodecyl p-hydroxybenzoate,dodecylparaben,n-dodecyl 4-hydroxybenzoate,p-hydroxybenzoic acid dodecyl ester,benzoic acid, 4-hydroxy-, dodecyl ester,p-oxybenzoesaureduodecylester,benzoic acid, p-hydroxy-, dodecyl ester,p-oxybenzoesaureduodecylester german,4-hydroxybenzoic acid dodecyl ester,laurylparaben PubChem CID: 17569 IUPAC Name: dodecyl 4-hydroxybenzoate SMILES: CCCCCCCCCCCCOC(=O)C1=CC=C(C=C1)O

PubChem CID 17569
CAS 2664-60-0
Molecular Weight (g/mol) 306.446
MDL Number MFCD00016473
SMILES CCCCCCCCCCCCOC(=O)C1=CC=C(C=C1)O
Synonym dodecyl p-hydroxybenzoate,dodecylparaben,n-dodecyl 4-hydroxybenzoate,p-hydroxybenzoic acid dodecyl ester,benzoic acid, 4-hydroxy-, dodecyl ester,p-oxybenzoesaureduodecylester,benzoic acid, p-hydroxy-, dodecyl ester,p-oxybenzoesaureduodecylester german,4-hydroxybenzoic acid dodecyl ester,laurylparaben
IUPAC Name dodecyl 4-hydroxybenzoate
InChI Key BAYSQTBAJQRACX-UHFFFAOYSA-N
Molecular Formula C19H30O3
7,149

4-Chlorobenzylamine 98.0+%, TCI America™

CAS: 104-86-9 Molecular Formula: C7H8ClN Molecular Weight (g/mol): 141.598 MDL Number: MFCD00008121 InChI Key: YMVFJGSXZNNUDW-UHFFFAOYSA-N Synonym: 4-chlorobenzylamine,4-chlorophenyl methanamine,p-chlorobenzylamine,benzenemethanamine, 4-chloro,1-4-chlorophenyl methanamine,4-chloro-benzylamine,benzylamine, p-chloro,4-chlorophenyl methylamine,para-chlorobenzylamine,chembl13218 PubChem CID: 66036 IUPAC Name: (4-chlorophenyl)methanamine SMILES: C1=CC(=CC=C1CN)Cl

PubChem CID 66036
CAS 104-86-9
Molecular Weight (g/mol) 141.598
MDL Number MFCD00008121
SMILES C1=CC(=CC=C1CN)Cl
Synonym 4-chlorobenzylamine,4-chlorophenyl methanamine,p-chlorobenzylamine,benzenemethanamine, 4-chloro,1-4-chlorophenyl methanamine,4-chloro-benzylamine,benzylamine, p-chloro,4-chlorophenyl methylamine,para-chlorobenzylamine,chembl13218
IUPAC Name (4-chlorophenyl)methanamine
InChI Key YMVFJGSXZNNUDW-UHFFFAOYSA-N
Molecular Formula C7H8ClN
7,150

Acetophenone p-Toluenesulfonylhydrazone 99.0+%, TCI America™

CAS: 4545-21-5 Molecular Formula: C15H16N2O2S Molecular Weight (g/mol): 288.365 MDL Number: MFCD01140191 InChI Key: MIXFDFCKBMCLGN-SSZFMOIBSA-N Synonym: acetophenone tosylhydrazone,4-methyl-n'-1z-1-phenylethylidene benzenesulfonohydrazide,acetophenonetosylhydrazone,4-methyl-n'-1e-1-phenylethylidene benzenesulfonohydrazide,acetophenone tosyl hydrazone,4-methyl-n-z-1-phenylethylideneamino benzenesulfonamide PubChem CID: 6287802 IUPAC Name: 4-methyl-N-[(Z)-1-phenylethylideneamino]benzenesulfonamide SMILES: CC1=CC=C(C=C1)S(=O)(=O)NN=C(C)C2=CC=CC=C2

PubChem CID 6287802
CAS 4545-21-5
Molecular Weight (g/mol) 288.365
MDL Number MFCD01140191
SMILES CC1=CC=C(C=C1)S(=O)(=O)NN=C(C)C2=CC=CC=C2
Synonym acetophenone tosylhydrazone,4-methyl-n'-1z-1-phenylethylidene benzenesulfonohydrazide,acetophenonetosylhydrazone,4-methyl-n'-1e-1-phenylethylidene benzenesulfonohydrazide,acetophenone tosyl hydrazone,4-methyl-n-z-1-phenylethylideneamino benzenesulfonamide
IUPAC Name 4-methyl-N-[(Z)-1-phenylethylideneamino]benzenesulfonamide
InChI Key MIXFDFCKBMCLGN-SSZFMOIBSA-N
Molecular Formula C15H16N2O2S
7,151

2,4,5-Trimethylbenzophenone 95.0+%, TCI America™

CAS: 52890-52-5 Molecular Formula: C16H16O Molecular Weight (g/mol): 224.303 InChI Key: FTPZYWUJDVZEIE-UHFFFAOYSA-N PubChem CID: 14907151 IUPAC Name: phenyl-(2,4,5-trimethylphenyl)methanone SMILES: CC1=CC(=C(C=C1C(=O)C2=CC=CC=C2)C)C

PubChem CID 14907151
CAS 52890-52-5
Molecular Weight (g/mol) 224.303
SMILES CC1=CC(=C(C=C1C(=O)C2=CC=CC=C2)C)C
IUPAC Name phenyl-(2,4,5-trimethylphenyl)methanone
InChI Key FTPZYWUJDVZEIE-UHFFFAOYSA-N
Molecular Formula C16H16O
7,152

3-Methoxyphenethyl Alcohol 98.0+%, TCI America™

CAS: 5020-41-7 Molecular Formula: C9H12O2 Molecular Weight (g/mol): 152.193 MDL Number: MFCD00002893 InChI Key: UPPGEJSCUZMCMW-UHFFFAOYSA-N Synonym: 2-3-methoxyphenyl ethanol,3-methoxyphenethyl alcohol,benzeneethanol, 3-methoxy,2-3-methoxyphenyl ethan-1-ol,phenethyl alcohol, m-methoxy,3-methoxybenzeneethanol,m-methoxyphenethyl alcohol,1-2-hydroxyethyl-3-methoxybenzene,acmc-20abd2,3-methoxyphenethylalcohol PubChem CID: 78724 IUPAC Name: 2-(3-methoxyphenyl)ethanol SMILES: COC1=CC=CC(=C1)CCO

PubChem CID 78724
CAS 5020-41-7
Molecular Weight (g/mol) 152.193
MDL Number MFCD00002893
SMILES COC1=CC=CC(=C1)CCO
Synonym 2-3-methoxyphenyl ethanol,3-methoxyphenethyl alcohol,benzeneethanol, 3-methoxy,2-3-methoxyphenyl ethan-1-ol,phenethyl alcohol, m-methoxy,3-methoxybenzeneethanol,m-methoxyphenethyl alcohol,1-2-hydroxyethyl-3-methoxybenzene,acmc-20abd2,3-methoxyphenethylalcohol
IUPAC Name 2-(3-methoxyphenyl)ethanol
InChI Key UPPGEJSCUZMCMW-UHFFFAOYSA-N
Molecular Formula C9H12O2
7,153

1-Heptyloxy-4-nitrobenzene, TCI America™

CAS: 13565-36-1 Molecular Formula: C13H19NO3 Molecular Weight (g/mol): 237.299 MDL Number: MFCD00024692 InChI Key: AVDKYVSWJDZALX-UHFFFAOYSA-N Synonym: Heptyl 4-Nitrophenyl Ether PubChem CID: 139499 IUPAC Name: 1-heptoxy-4-nitrobenzene SMILES: CCCCCCCOC1=CC=C(C=C1)[N+](=O)[O-]

PubChem CID 139499
CAS 13565-36-1
Molecular Weight (g/mol) 237.299
MDL Number MFCD00024692
SMILES CCCCCCCOC1=CC=C(C=C1)[N+](=O)[O-]
Synonym Heptyl 4-Nitrophenyl Ether
IUPAC Name 1-heptoxy-4-nitrobenzene
InChI Key AVDKYVSWJDZALX-UHFFFAOYSA-N
Molecular Formula C13H19NO3
7,154

3-Ethoxy-4-methoxybenzaldehyde 98.0+%, TCI America™

CAS: 1131-52-8 Molecular Formula: C10H12O3 Molecular Weight (g/mol): 180.203 MDL Number: MFCD00010128 InChI Key: VAMZHXWLGRQSJS-UHFFFAOYSA-N Synonym: 3-ethoxy-4-methoxy-benzaldehyde,benzaldehyde, 3-ethoxy-4-methoxy,pubchem13135,3-ethoxy-p-anisaldehyde,acmc-1ca82,3-ethoxy-4methoxybenzaldehyde,3ethoxy-4-methoxybenzaldehyde,ksc183c6j,3-ethoxy-4-methoxybenzaldehyd,4-methoxy-3-ethoxybenzaldehyde PubChem CID: 244728 IUPAC Name: 3-ethoxy-4-methoxybenzaldehyde SMILES: CCOC1=C(C=CC(=C1)C=O)OC

PubChem CID 244728
CAS 1131-52-8
Molecular Weight (g/mol) 180.203
MDL Number MFCD00010128
SMILES CCOC1=C(C=CC(=C1)C=O)OC
Synonym 3-ethoxy-4-methoxy-benzaldehyde,benzaldehyde, 3-ethoxy-4-methoxy,pubchem13135,3-ethoxy-p-anisaldehyde,acmc-1ca82,3-ethoxy-4methoxybenzaldehyde,3ethoxy-4-methoxybenzaldehyde,ksc183c6j,3-ethoxy-4-methoxybenzaldehyd,4-methoxy-3-ethoxybenzaldehyde
IUPAC Name 3-ethoxy-4-methoxybenzaldehyde
InChI Key VAMZHXWLGRQSJS-UHFFFAOYSA-N
Molecular Formula C10H12O3
7,155

3-Formylbenzonitrile 98.0+%, TCI America™

CAS: 24964-64-5 Molecular Formula: C8H5NO Molecular Weight (g/mol): 131.134 MDL Number: MFCD00003344 InChI Key: HGZJJKZPPMFIBU-UHFFFAOYSA-N Synonym: 3-cyanobenzaldehyde,m-cyanobenzaldehyde,benzonitrile, 3-formyl,m-formylbenzonitrile,m-cyanobenazldehyde,3-cyano benzaldehyde,3-formyl-benzonitrile,3-formylbenzenecarbonitrile,3cyano-benzaldehyde,m-cyano benzaldehyde PubChem CID: 90670 IUPAC Name: 3-formylbenzonitrile SMILES: C1=CC(=CC(=C1)C=O)C#N

PubChem CID 90670
CAS 24964-64-5
Molecular Weight (g/mol) 131.134
MDL Number MFCD00003344
SMILES C1=CC(=CC(=C1)C=O)C#N
Synonym 3-cyanobenzaldehyde,m-cyanobenzaldehyde,benzonitrile, 3-formyl,m-formylbenzonitrile,m-cyanobenazldehyde,3-cyano benzaldehyde,3-formyl-benzonitrile,3-formylbenzenecarbonitrile,3cyano-benzaldehyde,m-cyano benzaldehyde
IUPAC Name 3-formylbenzonitrile
InChI Key HGZJJKZPPMFIBU-UHFFFAOYSA-N
Molecular Formula C8H5NO