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Benzenoids

Organic compounds that are derived from or have a benzene group in their molecular structure. Benzene is an aromatic organic molecule composed of 6 carbon atoms and 6 hydrogen atoms that form a ring. Includes derivatives and substituted molecules.
Benzene and substituted derivatives (130,195)
Phenols (25,097)
Naphthalenes (6,366)
Phenol esters (4,814)
Unsubstituted Phenols (1,453)
Fluorenes (1,280)
Thiophenols (762)
Anthracenes (515)
Indanes (488)
Phenanthrenes and derivatives (364)
Tetralins (337)
Triphenyl compounds (278)
Pyrenes (277)
Dibenzocycloheptenes (60)
Naphthacenes (35)
Ellagic acids and derivatives (33)
Pentacenes (20)
Acenaphthylenes (16)
Pentacenequinones (16)
Perylenequinones (8)
1-hydroxylamino 2-unsubstituted benzenoids (6)

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4,816 – 4,830 of 159,106 results
4,816
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2-Bromo-5-fluorobenzaldehyde, 98%

CAS: 94569-84-3 Molecular Formula: C7H4BrFO Molecular Weight (g/mol): 203.01 MDL Number: MFCD00142872 InChI Key: CJUCIKJLMFVWIS-UHFFFAOYSA-N Synonym: benzaldehyde, 2-bromo-5-fluoro,2-bromo-5-fluorobenzaldhyde,5-fluoro-2-bromo benzaldehyde,2-bromo-5-fluoro-benzaldehyde,pubchem1418,acmc-209rsk,ksc494g0d,2-bromo-5-fluoro benzaldehyde,2-bromo-5-fluorobenzaldehyde PubChem CID: 2773321 IUPAC Name: 2-bromo-5-fluorobenzaldehyde SMILES: C1=CC(=C(C=C1F)C=O)Br

PubChem CID 2773321
CAS 94569-84-3
Molecular Weight (g/mol) 203.01
MDL Number MFCD00142872
SMILES C1=CC(=C(C=C1F)C=O)Br
Synonym benzaldehyde, 2-bromo-5-fluoro,2-bromo-5-fluorobenzaldhyde,5-fluoro-2-bromo benzaldehyde,2-bromo-5-fluoro-benzaldehyde,pubchem1418,acmc-209rsk,ksc494g0d,2-bromo-5-fluoro benzaldehyde,2-bromo-5-fluorobenzaldehyde
IUPAC Name 2-bromo-5-fluorobenzaldehyde
InChI Key CJUCIKJLMFVWIS-UHFFFAOYSA-N
Molecular Formula C7H4BrFO
4,817
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5-Chloro-2-fluorobenzaldehyde, 97%

CAS: 96515-79-6 Molecular Formula: C7H4ClFO Molecular Weight (g/mol): 158.56 MDL Number: MFCD03094518 InChI Key: WDTUCEMLUHTMCB-UHFFFAOYSA-N Synonym: 2-fluoro-5-chlorobenzaldehyde,3-chloro-6-fluoro benzaldehyde,3-chloro-6-fluorobenzaldehyde,5-chloro-2-fluoro-benzaldehyde,benzaldehyde, 5-chloro-2-fluoro,2-fluoro-5-chloro-benzaldehyde,zlchem 333,pubchem1411,ksc486m0t,2-fluoro-5-chloro benzaldehyde PubChem CID: 2773586 IUPAC Name: 5-chloro-2-fluorobenzaldehyde SMILES: FC1=CC=C(Cl)C=C1C=O

PubChem CID 2773586
CAS 96515-79-6
Molecular Weight (g/mol) 158.56
MDL Number MFCD03094518
SMILES FC1=CC=C(Cl)C=C1C=O
Synonym 2-fluoro-5-chlorobenzaldehyde,3-chloro-6-fluoro benzaldehyde,3-chloro-6-fluorobenzaldehyde,5-chloro-2-fluoro-benzaldehyde,benzaldehyde, 5-chloro-2-fluoro,2-fluoro-5-chloro-benzaldehyde,zlchem 333,pubchem1411,ksc486m0t,2-fluoro-5-chloro benzaldehyde
IUPAC Name 5-chloro-2-fluorobenzaldehyde
InChI Key WDTUCEMLUHTMCB-UHFFFAOYSA-N
Molecular Formula C7H4ClFO
4,818

O-phthalaldehyde, 99.1%, MP Biomedicals™

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 SMILES: O=CC1=CC=CC=C1C=O

PubChem CID 4807
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
InChI Key ZWLUXSQADUDCSB-UHFFFAOYSA-N
Molecular Formula C8H6O2
4,819
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2-Iodo-5-methoxybenzaldehyde, 96%

CAS: 77287-58-2 Molecular Formula: C8H7IO2 Molecular Weight (g/mol): 262.046 MDL Number: MFCD18905098 InChI Key: YHRFMOFYYPMQBE-UHFFFAOYSA-N Synonym: benzaldehyde, 2-iodo-5-methoxy,5-methoxy-2-iodobenzaldehyde,2-iodo-5-methoxybenzaldehyde PubChem CID: 10858258 IUPAC Name: 2-iodo-5-methoxybenzaldehyde SMILES: COC1=CC(=C(C=C1)I)C=O

PubChem CID 10858258
CAS 77287-58-2
Molecular Weight (g/mol) 262.046
MDL Number MFCD18905098
SMILES COC1=CC(=C(C=C1)I)C=O
Synonym benzaldehyde, 2-iodo-5-methoxy,5-methoxy-2-iodobenzaldehyde,2-iodo-5-methoxybenzaldehyde
IUPAC Name 2-iodo-5-methoxybenzaldehyde
InChI Key YHRFMOFYYPMQBE-UHFFFAOYSA-N
Molecular Formula C8H7IO2
4,820
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Di-n-hexyl phthalate, 97%, Thermo Scientific Chemicals

CAS: 84-75-3 Molecular Formula: C20H30O4 Molecular Weight (g/mol): 334.46 MDL Number: MFCD00043720 InChI Key: KCXZNSGUUQJJTR-UHFFFAOYSA-N Synonym: dihexyl phthalate,di-n-hexyl phthalate,di-n-hexylphthalate,phthalic acid, dihexyl ester,1,2-benzenedicarboxylic acid, dihexyl ester,phthalic acid di-n-hexyl ester,phthalic acid dihexyl ester,n-dihexyl phthalate,bis n-hexyl phthalate,dihexyl 1,2-benzenedicarboxylate PubChem CID: 6786 ChEBI: CHEBI:34678 IUPAC Name: dihexyl benzene-1,2-dicarboxylate SMILES: CCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCC

PubChem CID 6786
CAS 84-75-3
Molecular Weight (g/mol) 334.46
ChEBI CHEBI:34678
MDL Number MFCD00043720
SMILES CCCCCCOC(=O)C1=CC=CC=C1C(=O)OCCCCCC
Synonym dihexyl phthalate,di-n-hexyl phthalate,di-n-hexylphthalate,phthalic acid, dihexyl ester,1,2-benzenedicarboxylic acid, dihexyl ester,phthalic acid di-n-hexyl ester,phthalic acid dihexyl ester,n-dihexyl phthalate,bis n-hexyl phthalate,dihexyl 1,2-benzenedicarboxylate
IUPAC Name dihexyl benzene-1,2-dicarboxylate
InChI Key KCXZNSGUUQJJTR-UHFFFAOYSA-N
Molecular Formula C20H30O4
4,821
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2,4-Difluorobenzaldehyde, 98%

CAS: 1550-35-2 Molecular Formula: C7H4F2O Molecular Weight (g/mol): 142.11 MDL Number: MFCD00010326 InChI Key: WCGPCBACLBHDCI-UHFFFAOYSA-N PubChem CID: 73770 IUPAC Name: 2,4-difluorobenzaldehyde SMILES: FC1=CC=C(C=O)C(F)=C1

PubChem CID 73770
CAS 1550-35-2
Molecular Weight (g/mol) 142.11
MDL Number MFCD00010326
SMILES FC1=CC=C(C=O)C(F)=C1
IUPAC Name 2,4-difluorobenzaldehyde
InChI Key WCGPCBACLBHDCI-UHFFFAOYSA-N
Molecular Formula C7H4F2O
4,822

N-Methyl-2-(phenoxymethyl)benzylamine, 97%, Thermo Scientific™

CAS: 892502-17-9 Molecular Formula: C15H17NO Molecular Weight (g/mol): 227.307 MDL Number: MFCD09025894 InChI Key: WFUPXVCKIKJBIM-UHFFFAOYSA-N Synonym: n-methyl-2-phenoxymethyl benzylamine,methyl 2-phenoxymethyl phenyl methyl amine,n-methyl-1-2-phenoxymethyl phenyl methanamine,benzenemethanamine,n-methyl-2-phenoxymethyl PubChem CID: 18525895 IUPAC Name: N-methyl-1-[2-(phenoxymethyl)phenyl]methanamine SMILES: CNCC1=CC=CC=C1COC2=CC=CC=C2

PubChem CID 18525895
CAS 892502-17-9
Molecular Weight (g/mol) 227.307
MDL Number MFCD09025894
SMILES CNCC1=CC=CC=C1COC2=CC=CC=C2
Synonym n-methyl-2-phenoxymethyl benzylamine,methyl 2-phenoxymethyl phenyl methyl amine,n-methyl-1-2-phenoxymethyl phenyl methanamine,benzenemethanamine,n-methyl-2-phenoxymethyl
IUPAC Name N-methyl-1-[2-(phenoxymethyl)phenyl]methanamine
InChI Key WFUPXVCKIKJBIM-UHFFFAOYSA-N
Molecular Formula C15H17NO
4,823
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N,N'-Dibenzylethylenediamine, 97%

CAS: 140-28-3 Molecular Formula: C16H20N2 Molecular Weight (g/mol): 240.35 MDL Number: MFCD00004771 InChI Key: JUHORIMYRDESRB-UHFFFAOYSA-N Synonym: n,n'-dibenzylethylenediamine,benzathine,dbed,benzatin,n1,n2-dibenzylethane-1,2-diamine,1,2-bis benzylamino ethane,1,2-ethanediamine, n,n'-bis phenylmethyl,usaf do-53,unii-c659vz7p7t,ethylenediamine, n,n'-dibenzyl PubChem CID: 8793 ChEBI: CHEBI:51344 IUPAC Name: N,N'-dibenzylethane-1,2-diamine SMILES: C1=CC=C(C=C1)CNCCNCC2=CC=CC=C2

PubChem CID 8793
CAS 140-28-3
Molecular Weight (g/mol) 240.35
ChEBI CHEBI:51344
MDL Number MFCD00004771
SMILES C1=CC=C(C=C1)CNCCNCC2=CC=CC=C2
Synonym n,n'-dibenzylethylenediamine,benzathine,dbed,benzatin,n1,n2-dibenzylethane-1,2-diamine,1,2-bis benzylamino ethane,1,2-ethanediamine, n,n'-bis phenylmethyl,usaf do-53,unii-c659vz7p7t,ethylenediamine, n,n'-dibenzyl
IUPAC Name N,N'-dibenzylethane-1,2-diamine
InChI Key JUHORIMYRDESRB-UHFFFAOYSA-N
Molecular Formula C16H20N2
4,824
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Benzyltriethylammonium bromide, 99%

CAS: 5197-95-5 Molecular Formula: C13H22BrN Molecular Weight (g/mol): 272.23 MDL Number: MFCD00011822 InChI Key: CHQVQXZFZHACQQ-UHFFFAOYSA-M Synonym: benzyltriethylammonium bromide,n-benzyl-n,n-diethylethanaminium bromide,benzyl triethyl ammonium bromide,triethylbenzylammonium bromide,bteab,benzenemethanaminium, n,n,n-triethyl-, bromide,benzyltriethyl ammonium bromide,n-benzyl-n,n,n-triethylammoniumbromide,benzyltriethylazanium bromide,pubchem7797 PubChem CID: 165294 IUPAC Name: benzyl(triethyl)azanium;bromide SMILES: [Br-].CC[N+](CC)(CC)CC1=CC=CC=C1

PubChem CID 165294
CAS 5197-95-5
Molecular Weight (g/mol) 272.23
MDL Number MFCD00011822
SMILES [Br-].CC[N+](CC)(CC)CC1=CC=CC=C1
Synonym benzyltriethylammonium bromide,n-benzyl-n,n-diethylethanaminium bromide,benzyl triethyl ammonium bromide,triethylbenzylammonium bromide,bteab,benzenemethanaminium, n,n,n-triethyl-, bromide,benzyltriethyl ammonium bromide,n-benzyl-n,n,n-triethylammoniumbromide,benzyltriethylazanium bromide,pubchem7797
IUPAC Name benzyl(triethyl)azanium;bromide
InChI Key CHQVQXZFZHACQQ-UHFFFAOYSA-M
Molecular Formula C13H22BrN
4,825
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3,4,5-Trimethoxybenzylamine, 96%

CAS: 18638-99-8 Molecular Formula: C10H15NO3 Molecular Weight (g/mol): 197.24 MDL Number: MFCD00017150 InChI Key: YUPUSBMJCFBHAP-UHFFFAOYSA-N Synonym: 3,4,5-trimethoxybenzylamine,3,4,5-trimethoxyphenyl methanamine,1-3,4,5-trimethoxyphenyl methanamine,benzenemethanamine, 3,4,5-trimethoxy,3,4,5-trimethoxyphenyl methylamine,1-3,4,5-trimethoxyphenyl methanamine hydrochloride,pubchem16674,acmc-1c5ez,ksc495e6b,3,4,5-trimethoxy benzylamine PubChem CID: 87736 IUPAC Name: (3,4,5-trimethoxyphenyl)methanamine SMILES: COC1=CC(=CC(=C1OC)OC)CN

PubChem CID 87736
CAS 18638-99-8
Molecular Weight (g/mol) 197.24
MDL Number MFCD00017150
SMILES COC1=CC(=CC(=C1OC)OC)CN
Synonym 3,4,5-trimethoxybenzylamine,3,4,5-trimethoxyphenyl methanamine,1-3,4,5-trimethoxyphenyl methanamine,benzenemethanamine, 3,4,5-trimethoxy,3,4,5-trimethoxyphenyl methylamine,1-3,4,5-trimethoxyphenyl methanamine hydrochloride,pubchem16674,acmc-1c5ez,ksc495e6b,3,4,5-trimethoxy benzylamine
IUPAC Name (3,4,5-trimethoxyphenyl)methanamine
InChI Key YUPUSBMJCFBHAP-UHFFFAOYSA-N
Molecular Formula C10H15NO3
4,826

{4-[(4-Methylperhydro-1,4-diazepin-1-yl)methyl]phenyl}methanol, 97%, Thermo Scientific™

CAS: 884507-50-0 Molecular Formula: C14H22N2O Molecular Weight (g/mol): 234.343 MDL Number: MFCD09064973 InChI Key: YQUWAYPNHCWYNU-UHFFFAOYSA-N Synonym: 4-4-methylperhydro-1,4-diazepin-1-yl methyl phenyl methanol,4-4-methyl-1,4-diazepan-1-yl methyl phenyl methanol,4-4-methyl-1,4-diazaperhydroepinyl methyl phenyl methan-1-ol,benzenemethanol,4-hexahydro-4-methyl-1h-1,4-diazepin-1-yl methyl PubChem CID: 24229552 IUPAC Name: [4-[(4-methyl-1,4-diazepan-1-yl)methyl]phenyl]methanol SMILES: CN1CCCN(CC1)CC2=CC=C(C=C2)CO

PubChem CID 24229552
CAS 884507-50-0
Molecular Weight (g/mol) 234.343
MDL Number MFCD09064973
SMILES CN1CCCN(CC1)CC2=CC=C(C=C2)CO
Synonym 4-4-methylperhydro-1,4-diazepin-1-yl methyl phenyl methanol,4-4-methyl-1,4-diazepan-1-yl methyl phenyl methanol,4-4-methyl-1,4-diazaperhydroepinyl methyl phenyl methan-1-ol,benzenemethanol,4-hexahydro-4-methyl-1h-1,4-diazepin-1-yl methyl
IUPAC Name [4-[(4-methyl-1,4-diazepan-1-yl)methyl]phenyl]methanol
InChI Key YQUWAYPNHCWYNU-UHFFFAOYSA-N
Molecular Formula C14H22N2O
4,827

2,2,4,4,6,8,8-Heptamethylnonane, 98.3%, MP Biomedicals™

CAS: 4393-09-3 Molecular Formula: C9H13NO2 Molecular Weight (g/mol): 167.21 InChI Key: LVMPWFJVYMXSNY-UHFFFAOYSA-N Synonym: 2,3-dimethoxybenzylamine,2,3-dimethoxyphenyl methanamine,1-2,3-dimethoxyphenyl methanamine,benzenemethanamine, 2,3-dimethoxy,2,3-dimethoxy-benzylamine,2,3-dimethoxy benzylamine,pubchem7399,2,3-dimethoxybenzyl amine,acmc-2097fc PubChem CID: 78106 IUPAC Name: (2,3-dimethoxyphenyl)methanamine SMILES: COC1=CC=CC(=C1OC)CN

PubChem CID 78106
CAS 4393-09-3
Molecular Weight (g/mol) 167.21
SMILES COC1=CC=CC(=C1OC)CN
Synonym 2,3-dimethoxybenzylamine,2,3-dimethoxyphenyl methanamine,1-2,3-dimethoxyphenyl methanamine,benzenemethanamine, 2,3-dimethoxy,2,3-dimethoxy-benzylamine,2,3-dimethoxy benzylamine,pubchem7399,2,3-dimethoxybenzyl amine,acmc-2097fc
IUPAC Name (2,3-dimethoxyphenyl)methanamine
InChI Key LVMPWFJVYMXSNY-UHFFFAOYSA-N
Molecular Formula C9H13NO2
4,828

4-[3-(Dimethylamino)propoxy]-N-methylbenzylamine, 90%, Thermo Scientific™

CAS: 910037-04-6 Molecular Formula: C13H22N2O Molecular Weight (g/mol): 222.332 MDL Number: MFCD09064994 InChI Key: LFLFEMOINFHORX-UHFFFAOYSA-N Synonym: 4-3-dimethylamino propoxy-n-methylbenzylamine,dimethyl 3-4-methylamino methyl phenoxy propyl amine,n,n-dimethyl-3-4-methylamino methyl phenoxy propan-1-amine,4-3-dimethylamino propoxy phenyl methyl methyl amine,benzenemethanamine, 4-3-dimethylamino propoxy-n-methyl PubChem CID: 24229610 IUPAC Name: N,N-dimethyl-3-[4-(methylaminomethyl)phenoxy]propan-1-amine SMILES: CNCC1=CC=C(C=C1)OCCCN(C)C

PubChem CID 24229610
CAS 910037-04-6
Molecular Weight (g/mol) 222.332
MDL Number MFCD09064994
SMILES CNCC1=CC=C(C=C1)OCCCN(C)C
Synonym 4-3-dimethylamino propoxy-n-methylbenzylamine,dimethyl 3-4-methylamino methyl phenoxy propyl amine,n,n-dimethyl-3-4-methylamino methyl phenoxy propan-1-amine,4-3-dimethylamino propoxy phenyl methyl methyl amine,benzenemethanamine, 4-3-dimethylamino propoxy-n-methyl
IUPAC Name N,N-dimethyl-3-[4-(methylaminomethyl)phenoxy]propan-1-amine
InChI Key LFLFEMOINFHORX-UHFFFAOYSA-N
Molecular Formula C13H22N2O
4,829

3-[(4-Methylperhydro-1,4-diazepin-1-yl)methyl]benzylamine, 95%, Thermo Scientific™

CAS: 915707-48-1 Molecular Formula: C14H23N3 Molecular Weight (g/mol): 233.36 MDL Number: MFCD09787493 InChI Key: MSLZRDIUXASDJH-UHFFFAOYSA-N Synonym: 3-4-methylperhydro-1,4-diazepin-1-yl methyl benzylamine,3-4-methylhomopiperazin-1-yl methyl benzylamine,3-4-methyl-1,4-diazepan-1-yl methyl phenyl methanamine,1-3-4-methyl-1,4-diazepan-1-yl methyl phenyl methanamine,3-4-methyl-1,4-diazaperhydroepinyl methyl phenyl methylamine,benzenemethanamine,3-hexahydro-4-methyl-1h-1,4-diazepin-1-yl methyl,3-4-methylhomopiperazin-1-yl methyl benzylamine, 3-4-methyl-1,4-diazepan-1-yl methyl phenyl methylamine PubChem CID: 24229554 IUPAC Name: [3-[(4-methyl-1,4-diazepan-1-yl)methyl]phenyl]methanamine SMILES: CN1CCCN(CC2=CC(CN)=CC=C2)CC1

PubChem CID 24229554
CAS 915707-48-1
Molecular Weight (g/mol) 233.36
MDL Number MFCD09787493
SMILES CN1CCCN(CC2=CC(CN)=CC=C2)CC1
Synonym 3-4-methylperhydro-1,4-diazepin-1-yl methyl benzylamine,3-4-methylhomopiperazin-1-yl methyl benzylamine,3-4-methyl-1,4-diazepan-1-yl methyl phenyl methanamine,1-3-4-methyl-1,4-diazepan-1-yl methyl phenyl methanamine,3-4-methyl-1,4-diazaperhydroepinyl methyl phenyl methylamine,benzenemethanamine,3-hexahydro-4-methyl-1h-1,4-diazepin-1-yl methyl,3-4-methylhomopiperazin-1-yl methyl benzylamine, 3-4-methyl-1,4-diazepan-1-yl methyl phenyl methylamine
IUPAC Name [3-[(4-methyl-1,4-diazepan-1-yl)methyl]phenyl]methanamine
InChI Key MSLZRDIUXASDJH-UHFFFAOYSA-N
Molecular Formula C14H23N3
4,830
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2-Hydroxybenzylamine, 98%

CAS: 932-30-9 Molecular Formula: C7H9NO Molecular Weight (g/mol): 123.15 MDL Number: MFCD00870498 InChI Key: KPRZOPQOBJRYSW-UHFFFAOYSA-N Synonym: 2-aminomethyl phenol,2-hydroxybenzylamine,phenol, 2-aminomethyl,o-hydroxybenzylamine,2-hydroxyphenyl methylamine,unii-696r5n4nrm,salicylamine,aminomethyl phenol,o-aminomethylphenol,o-hydroxy-benzylamine PubChem CID: 70267 IUPAC Name: 2-(aminomethyl)phenol SMILES: C1=CC=C(C(=C1)CN)O

PubChem CID 70267
CAS 932-30-9
Molecular Weight (g/mol) 123.15
MDL Number MFCD00870498
SMILES C1=CC=C(C(=C1)CN)O
Synonym 2-aminomethyl phenol,2-hydroxybenzylamine,phenol, 2-aminomethyl,o-hydroxybenzylamine,2-hydroxyphenyl methylamine,unii-696r5n4nrm,salicylamine,aminomethyl phenol,o-aminomethylphenol,o-hydroxy-benzylamine
IUPAC Name 2-(aminomethyl)phenol
InChI Key KPRZOPQOBJRYSW-UHFFFAOYSA-N
Molecular Formula C7H9NO