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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.
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1,966 – 1,980 of 64,662 results
1,966
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2-Aminobenzyl alcohol, 98%

CAS: 5344-90-1 Molecular Formula: C7H9NO Molecular Weight (g/mol): 123.15 MDL Number: MFCD00007749 InChI Key: VYFOAVADNIHPTR-UHFFFAOYSA-N Synonym: 2-aminobenzyl alcohol,2-aminophenyl methanol,2-aminobenzylalcohol,o-aminobenzyl alcohol,2-aminobenzenemethanol,benzenemethanol, 2-amino,o-aminobenzylic alcohol,o-hydroxymethyl aniline,benzyl alcohol, o-amino,2-hydroxymethylaniline PubChem CID: 21439 IUPAC Name: (2-aminophenyl)methanol SMILES: C1=CC=C(C(=C1)CO)N

PubChem CID 21439
CAS 5344-90-1
Molecular Weight (g/mol) 123.15
MDL Number MFCD00007749
SMILES C1=CC=C(C(=C1)CO)N
Synonym 2-aminobenzyl alcohol,2-aminophenyl methanol,2-aminobenzylalcohol,o-aminobenzyl alcohol,2-aminobenzenemethanol,benzenemethanol, 2-amino,o-aminobenzylic alcohol,o-hydroxymethyl aniline,benzyl alcohol, o-amino,2-hydroxymethylaniline
IUPAC Name (2-aminophenyl)methanol
InChI Key VYFOAVADNIHPTR-UHFFFAOYSA-N
Molecular Formula C7H9NO
1,967
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2-Methyl-3-nitroaniline, 97%

CAS: 603-83-8 Molecular Formula: C7H8N2O2 Molecular Weight (g/mol): 152.15 MDL Number: MFCD00007731 InChI Key: HFCFJYRLBAANKN-UHFFFAOYSA-N Synonym: 2-amino-6-nitrotoluene,3-nitro-o-toluidine,benzenamine, 2-methyl-3-nitro,o-toluidine, 3-nitro,2-methyl-3-nitro-aniline,1-amino-2-methyl-3-nitrobenzene,2-nitro-6-aminotoluene,2-methyl-3-nitrobenzenamine,2-methyl-3-nitro-phenylamine,2-methyl-3-nitrophenyl amine PubChem CID: 11783 IUPAC Name: 2-methyl-3-nitroaniline SMILES: CC1=C(N)C=CC=C1[N+]([O-])=O

PubChem CID 11783
CAS 603-83-8
Molecular Weight (g/mol) 152.15
MDL Number MFCD00007731
SMILES CC1=C(N)C=CC=C1[N+]([O-])=O
Synonym 2-amino-6-nitrotoluene,3-nitro-o-toluidine,benzenamine, 2-methyl-3-nitro,o-toluidine, 3-nitro,2-methyl-3-nitro-aniline,1-amino-2-methyl-3-nitrobenzene,2-nitro-6-aminotoluene,2-methyl-3-nitrobenzenamine,2-methyl-3-nitro-phenylamine,2-methyl-3-nitrophenyl amine
IUPAC Name 2-methyl-3-nitroaniline
InChI Key HFCFJYRLBAANKN-UHFFFAOYSA-N
Molecular Formula C7H8N2O2
1,968
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4-Fluoro-3-nitrobenzaldehyde, 97%, Thermo Scientific™

CAS: 42564-51-2 Molecular Formula: C7H4FNO3 Molecular Weight (g/mol): 169.11 MDL Number: MFCD01861388 InChI Key: ILKWFRCNNILIJW-UHFFFAOYSA-N Synonym: 3-nitro-4-fluorobenzaldehyde,benzaldehyde, 4-fluoro-3-nitro,4-fluoro-3-nitro-benzaldehyde,pubchem22572,acmc-1ao2q,3-nitro-4 fluorobenzaldehyde,ksc497m9r,2-fluoro-5-formylnitrobenzene,#,4-fluoranyl-3-nitro-benzaldehyde PubChem CID: 598129 IUPAC Name: 4-fluoro-3-nitrobenzaldehyde SMILES: C1=CC(=C(C=C1C=O)[N+](=O)[O-])F

PubChem CID 598129
CAS 42564-51-2
Molecular Weight (g/mol) 169.11
MDL Number MFCD01861388
SMILES C1=CC(=C(C=C1C=O)[N+](=O)[O-])F
Synonym 3-nitro-4-fluorobenzaldehyde,benzaldehyde, 4-fluoro-3-nitro,4-fluoro-3-nitro-benzaldehyde,pubchem22572,acmc-1ao2q,3-nitro-4 fluorobenzaldehyde,ksc497m9r,2-fluoro-5-formylnitrobenzene,#,4-fluoranyl-3-nitro-benzaldehyde
IUPAC Name 4-fluoro-3-nitrobenzaldehyde
InChI Key ILKWFRCNNILIJW-UHFFFAOYSA-N
Molecular Formula C7H4FNO3
1,969
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2,4,6-Trifluorobenzotrifluoride, 96%

CAS: 122030-04-0 Molecular Formula: C7H2F6 Molecular Weight (g/mol): 200.083 MDL Number: MFCD00190109 InChI Key: SGPXFVDJRSZIPK-UHFFFAOYSA-N Synonym: 2,4,6-trifluorobenzotrifluoride,1,3,5-trifluoro-2-trifluoromethyl benzene,pubchem4877,2,4,6-trifluorobenzotrifluorode,2,4,6-tri-fluorobenzotrifluoride,benzene, 1,3,5-trifluoro-2-trifluoromethyl,alpha,alpha,alpha,2,4,6-hexafluorotoluene,alpha,alpha,alpha,2,4,6-hexafluorotoluene;1,3,5-trifluoro-2-trifluoromethyl benzene PubChem CID: 2734030 IUPAC Name: 1,3,5-trifluoro-2-(trifluoromethyl)benzene SMILES: C1=C(C=C(C(=C1F)C(F)(F)F)F)F

PubChem CID 2734030
CAS 122030-04-0
Molecular Weight (g/mol) 200.083
MDL Number MFCD00190109
SMILES C1=C(C=C(C(=C1F)C(F)(F)F)F)F
Synonym 2,4,6-trifluorobenzotrifluoride,1,3,5-trifluoro-2-trifluoromethyl benzene,pubchem4877,2,4,6-trifluorobenzotrifluorode,2,4,6-tri-fluorobenzotrifluoride,benzene, 1,3,5-trifluoro-2-trifluoromethyl,alpha,alpha,alpha,2,4,6-hexafluorotoluene,alpha,alpha,alpha,2,4,6-hexafluorotoluene;1,3,5-trifluoro-2-trifluoromethyl benzene
IUPAC Name 1,3,5-trifluoro-2-(trifluoromethyl)benzene
InChI Key SGPXFVDJRSZIPK-UHFFFAOYSA-N
Molecular Formula C7H2F6
1,970

2-[3-(Dimethylamino)propoxy]benzylamine, 97%, Thermo Scientific™

CAS: 916766-87-5 Molecular Formula: C12H20N2O Molecular Weight (g/mol): 208.305 MDL Number: MFCD09064996 InChI Key: CWYPVGNYPWEJLK-UHFFFAOYSA-N Synonym: 2-3-dimethylamino propoxy benzylamine,2-3-dimethylamino propoxy phenyl methanamine,3-2-aminomethyl phenoxy-n,n-dimethylpropan-1-amine,3-2-aminomethyl phenoxy propyl dimethylamine,benzenemethanamine, 2-3-dimethylamino propoxy,3-2-aminomethyl phenoxy-n,n-dimethylpropylamine PubChem CID: 21465422 IUPAC Name: 3-[2-(aminomethyl)phenoxy]-N,N-dimethylpropan-1-amine SMILES: CN(C)CCCOC1=CC=CC=C1CN

PubChem CID 21465422
CAS 916766-87-5
Molecular Weight (g/mol) 208.305
MDL Number MFCD09064996
SMILES CN(C)CCCOC1=CC=CC=C1CN
Synonym 2-3-dimethylamino propoxy benzylamine,2-3-dimethylamino propoxy phenyl methanamine,3-2-aminomethyl phenoxy-n,n-dimethylpropan-1-amine,3-2-aminomethyl phenoxy propyl dimethylamine,benzenemethanamine, 2-3-dimethylamino propoxy,3-2-aminomethyl phenoxy-n,n-dimethylpropylamine
IUPAC Name 3-[2-(aminomethyl)phenoxy]-N,N-dimethylpropan-1-amine
InChI Key CWYPVGNYPWEJLK-UHFFFAOYSA-N
Molecular Formula C12H20N2O
1,971
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4-Iodobenzoic acid, 97%

CAS: 619-58-9 Molecular Formula: C7H5IO2 Molecular Weight (g/mol): 248.02 MDL Number: MFCD00002533 InChI Key: GHICCUXQJBDNRN-UHFFFAOYSA-N Synonym: p-iodobenzoic acid,benzoic acid, 4-iodo,benzoic acid, p-iodo,4-iodo-benzoic acid,p-iodobenzenecarboxylic acid,4-jodbenzoesaeure,unii-ipo4lyq1en,4-jodbenzoesaeure german,4-iodo benzoic acid,ipo4lyq1en PubChem CID: 12085 IUPAC Name: 4-iodobenzoic acid SMILES: OC(=O)C1=CC=C(I)C=C1

PubChem CID 12085
CAS 619-58-9
Molecular Weight (g/mol) 248.02
MDL Number MFCD00002533
SMILES OC(=O)C1=CC=C(I)C=C1
Synonym p-iodobenzoic acid,benzoic acid, 4-iodo,benzoic acid, p-iodo,4-iodo-benzoic acid,p-iodobenzenecarboxylic acid,4-jodbenzoesaeure,unii-ipo4lyq1en,4-jodbenzoesaeure german,4-iodo benzoic acid,ipo4lyq1en
IUPAC Name 4-iodobenzoic acid
InChI Key GHICCUXQJBDNRN-UHFFFAOYSA-N
Molecular Formula C7H5IO2
1,972
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5-Nitrovanillin, 97%

CAS: 6635-20-7 Molecular Formula: C8H7NO5 Molecular Weight (g/mol): 197.146 MDL Number: MFCD00007118 InChI Key: ZEHYRTJBFMZHCY-UHFFFAOYSA-N Synonym: 5-nitrovanillin,4-hydroxy-3-methoxy-5-nitrobenzaldehyde,vanillin, 5-nitro,benzaldehyde, 4-hydroxy-3-methoxy-5-nitro,3-methoxy-4-hydroxy-5-nitrobenzaldhyde,3-methoxy-4-hydroxy-5-nitrobenzaldehyde,4-hydroxy-3-methoxy-5-nitro-benzaldehyde,4-hydroxy-3-nitro-5-methoxybenzaldehyde,4-hydroxy-5-methoxy-3-nitrobenzaldehyde,5-nitrovanilline PubChem CID: 81134 ChEBI: CHEBI:48385 SMILES: COC1=CC(=CC(=C1O)[N+](=O)[O-])C=O

PubChem CID 81134
CAS 6635-20-7
Molecular Weight (g/mol) 197.146
ChEBI CHEBI:48385
MDL Number MFCD00007118
SMILES COC1=CC(=CC(=C1O)[N+](=O)[O-])C=O
Synonym 5-nitrovanillin,4-hydroxy-3-methoxy-5-nitrobenzaldehyde,vanillin, 5-nitro,benzaldehyde, 4-hydroxy-3-methoxy-5-nitro,3-methoxy-4-hydroxy-5-nitrobenzaldhyde,3-methoxy-4-hydroxy-5-nitrobenzaldehyde,4-hydroxy-3-methoxy-5-nitro-benzaldehyde,4-hydroxy-3-nitro-5-methoxybenzaldehyde,4-hydroxy-5-methoxy-3-nitrobenzaldehyde,5-nitrovanilline
InChI Key ZEHYRTJBFMZHCY-UHFFFAOYSA-N
Molecular Formula C8H7NO5
1,973
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3-Methoxybenzyl chloride, 97%

CAS: 824-98-6 Molecular Formula: C8H9ClO Molecular Weight (g/mol): 156.61 MDL Number: MFCD00000907 InChI Key: VGISFWWEOGVMED-UHFFFAOYSA-N Synonym: 3-methoxybenzyl chloride,1-chloromethyl-3-methoxybenzene,m-methoxybenzyl chloride,m-chloromethyl anisole,benzene, 1-chloromethyl-3-methoxy,anisole, m-chloromethyl,3-methoxybenzylchloride,3-chloromethyl anisole,3-methoxy benzyl chloride,benzyl chloride,3-methoxy PubChem CID: 69994 IUPAC Name: 1-(chloromethyl)-3-methoxybenzene SMILES: COC1=CC=CC(CCl)=C1

PubChem CID 69994
CAS 824-98-6
Molecular Weight (g/mol) 156.61
MDL Number MFCD00000907
SMILES COC1=CC=CC(CCl)=C1
Synonym 3-methoxybenzyl chloride,1-chloromethyl-3-methoxybenzene,m-methoxybenzyl chloride,m-chloromethyl anisole,benzene, 1-chloromethyl-3-methoxy,anisole, m-chloromethyl,3-methoxybenzylchloride,3-chloromethyl anisole,3-methoxy benzyl chloride,benzyl chloride,3-methoxy
IUPAC Name 1-(chloromethyl)-3-methoxybenzene
InChI Key VGISFWWEOGVMED-UHFFFAOYSA-N
Molecular Formula C8H9ClO
1,974

4-Aminoveratrole, 98%

CAS: 6315-89-5 Molecular Formula: C8H11NO2 Molecular Weight (g/mol): 153.18 MDL Number: MFCD00008394 InChI Key: LGDHZCLREKIGKJ-UHFFFAOYSA-N Synonym: 4-aminoveratrole,benzenamine, 3,4-dimethoxy,4-aminoveratrol,3,4-dimethoxybenzenamine,2-methoxy-4-aminoanisole,3,4-dimethoxy aniline,aniline, 3,4-dimethoxy,3,4-dimethyloxy aniline,3,4-dimethoxy-phenylamine PubChem CID: 22770 IUPAC Name: 3,4-dimethoxyaniline SMILES: COC1=C(C=C(C=C1)N)OC

PubChem CID 22770
CAS 6315-89-5
Molecular Weight (g/mol) 153.18
MDL Number MFCD00008394
SMILES COC1=C(C=C(C=C1)N)OC
Synonym 4-aminoveratrole,benzenamine, 3,4-dimethoxy,4-aminoveratrol,3,4-dimethoxybenzenamine,2-methoxy-4-aminoanisole,3,4-dimethoxy aniline,aniline, 3,4-dimethoxy,3,4-dimethyloxy aniline,3,4-dimethoxy-phenylamine
IUPAC Name 3,4-dimethoxyaniline
InChI Key LGDHZCLREKIGKJ-UHFFFAOYSA-N
Molecular Formula C8H11NO2
1,975
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4-Methyl-2-nitroaniline, 99%

CAS: 89-62-3 Molecular Formula: C7H8N2O2 Molecular Weight (g/mol): 152.15 MDL Number: MFCD00007907 InChI Key: DLURHXYXQYMPLT-UHFFFAOYSA-N Synonym: 2-nitro-p-toluidine,4-amino-3-nitrotoluene,3-nitro-4-toluidine,fast red gl,3-nitro-4-aminotoluene,fast red gl base,benzenamine, 4-methyl-2-nitro,2-nitro-4-methylaniline,4-methyl-6-nitroaniline,mnpt PubChem CID: 6978 ChEBI: CHEBI:66920 IUPAC Name: 4-methyl-2-nitroaniline SMILES: CC1=CC=C(N)C(=C1)[N+]([O-])=O

PubChem CID 6978
CAS 89-62-3
Molecular Weight (g/mol) 152.15
ChEBI CHEBI:66920
MDL Number MFCD00007907
SMILES CC1=CC=C(N)C(=C1)[N+]([O-])=O
Synonym 2-nitro-p-toluidine,4-amino-3-nitrotoluene,3-nitro-4-toluidine,fast red gl,3-nitro-4-aminotoluene,fast red gl base,benzenamine, 4-methyl-2-nitro,2-nitro-4-methylaniline,4-methyl-6-nitroaniline,mnpt
IUPAC Name 4-methyl-2-nitroaniline
InChI Key DLURHXYXQYMPLT-UHFFFAOYSA-N
Molecular Formula C7H8N2O2
1,976
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2-Fluoroaniline, 99+%

CAS: 348-54-9 Molecular Formula: C6H6FN Molecular Weight (g/mol): 111.12 MDL Number: MFCD00007642 InChI Key: FTZQXOJYPFINKJ-UHFFFAOYSA-N Synonym: o-fluoroaniline,benzenamine, 2-fluoro,1-amino-2-fluorobenzene,2-fluorobenzenamine,2-fluoro-phenylamine,2-fluoro-benzenamine,fluoroaniline-2,o-aminofluorobenzene,aniline, o-fluoro,2-fluorophenylamine PubChem CID: 9584 ChEBI: CHEBI:27526 IUPAC Name: 2-fluoroaniline SMILES: NC1=CC=CC=C1F

PubChem CID 9584
CAS 348-54-9
Molecular Weight (g/mol) 111.12
ChEBI CHEBI:27526
MDL Number MFCD00007642
SMILES NC1=CC=CC=C1F
Synonym o-fluoroaniline,benzenamine, 2-fluoro,1-amino-2-fluorobenzene,2-fluorobenzenamine,2-fluoro-phenylamine,2-fluoro-benzenamine,fluoroaniline-2,o-aminofluorobenzene,aniline, o-fluoro,2-fluorophenylamine
IUPAC Name 2-fluoroaniline
InChI Key FTZQXOJYPFINKJ-UHFFFAOYSA-N
Molecular Formula C6H6FN
1,977
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N-(Diphenylmethylene)aminoacetonitrile, 99%

CAS: 70591-20-7 Molecular Formula: C15H12N2 Molecular Weight (g/mol): 220.28 MDL Number: MFCD00009970 InChI Key: VRLJFRODHVSTIK-UHFFFAOYSA-N Synonym: n-diphenylmethylene aminoacetonitrile,2-diphenylmethylene amino acetonitrile,benzhydrylidene-amino-acetonitrile,2-benzhydrylideneamino acetonitrile,2-diphenylmethylidene amino acetonitrile,acetonitrile, diphenylmethylene amino,4,4-diphenyl-3-azabut-3-enenitrile,pubchem13883,benzhydrylideneaminoacetonitrile PubChem CID: 612957 IUPAC Name: 2-(benzhydrylideneamino)acetonitrile SMILES: N#CCN=C(C1=CC=CC=C1)C1=CC=CC=C1

PubChem CID 612957
CAS 70591-20-7
Molecular Weight (g/mol) 220.28
MDL Number MFCD00009970
SMILES N#CCN=C(C1=CC=CC=C1)C1=CC=CC=C1
Synonym n-diphenylmethylene aminoacetonitrile,2-diphenylmethylene amino acetonitrile,benzhydrylidene-amino-acetonitrile,2-benzhydrylideneamino acetonitrile,2-diphenylmethylidene amino acetonitrile,acetonitrile, diphenylmethylene amino,4,4-diphenyl-3-azabut-3-enenitrile,pubchem13883,benzhydrylideneaminoacetonitrile
IUPAC Name 2-(benzhydrylideneamino)acetonitrile
InChI Key VRLJFRODHVSTIK-UHFFFAOYSA-N
Molecular Formula C15H12N2
1,978
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3-Methoxyphenylacetic acid, 99.5%

CAS: 1798-09-0 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00004334 InChI Key: LEGPZHPSIPPYIO-UHFFFAOYSA-N Synonym: 3-methoxyphenylacetic acid,2-3-methoxyphenyl acetic acid,m-methoxyphenylacetic acid,3-methoxyphenyl acetic acid,3-methoxybenzeneacetic acid,benzeneacetic acid, 3-methoxy,acetic acid, m-methoxyphenyl,unii-25xlo0t6my,3-methoxy-phenyl-acetic acid,25xlo0t6my PubChem CID: 15719 IUPAC Name: 2-(3-methoxyphenyl)acetic acid SMILES: COC1=CC=CC(=C1)CC(=O)O

PubChem CID 15719
CAS 1798-09-0
Molecular Weight (g/mol) 166.18
MDL Number MFCD00004334
SMILES COC1=CC=CC(=C1)CC(=O)O
Synonym 3-methoxyphenylacetic acid,2-3-methoxyphenyl acetic acid,m-methoxyphenylacetic acid,3-methoxyphenyl acetic acid,3-methoxybenzeneacetic acid,benzeneacetic acid, 3-methoxy,acetic acid, m-methoxyphenyl,unii-25xlo0t6my,3-methoxy-phenyl-acetic acid,25xlo0t6my
IUPAC Name 2-(3-methoxyphenyl)acetic acid
InChI Key LEGPZHPSIPPYIO-UHFFFAOYSA-N
Molecular Formula C9H10O3
1,979
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Guaifenesin, USP, 98-102%, Spectrum™ Chemical
SDP

CAS: 93-14-1 Molecular Formula: C10H14O4 Molecular Weight (g/mol): 198.22 MDL Number: MFCD00016873 InChI Key: HSRJKNPTNIJEKV-UHFFFAOYNA-N IUPAC Name: 3-(2-methoxyphenoxy)propane-1,2-diol SMILES: COC1=CC=CC=C1OCC(O)CO

CAS 93-14-1
Molecular Weight (g/mol) 198.22
MDL Number MFCD00016873
SMILES COC1=CC=CC=C1OCC(O)CO
IUPAC Name 3-(2-methoxyphenoxy)propane-1,2-diol
InChI Key HSRJKNPTNIJEKV-UHFFFAOYNA-N
Molecular Formula C10H14O4
1,980
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2,3-Difluoro-6-methoxybenzoic acid, 97%

CAS: 773873-26-0 Molecular Formula: C8H6F2O3 Molecular Weight (g/mol): 188.13 MDL Number: MFCD04116018 InChI Key: MMTKYWQMCSZCGW-UHFFFAOYSA-N Synonym: 2,3-difluoro-6-methoxy-benzoic acid,pubchem4940,2,3-difluoro-6-methoxybenzoicacid,benzoic acid,2,3-difluoro-6-methoxy PubChem CID: 3861323 IUPAC Name: 2,3-difluoro-6-methoxybenzoic acid SMILES: COC1=C(C(=C(C=C1)F)F)C(=O)O

PubChem CID 3861323
CAS 773873-26-0
Molecular Weight (g/mol) 188.13
MDL Number MFCD04116018
SMILES COC1=C(C(=C(C=C1)F)F)C(=O)O
Synonym 2,3-difluoro-6-methoxy-benzoic acid,pubchem4940,2,3-difluoro-6-methoxybenzoicacid,benzoic acid,2,3-difluoro-6-methoxy
IUPAC Name 2,3-difluoro-6-methoxybenzoic acid
InChI Key MMTKYWQMCSZCGW-UHFFFAOYSA-N
Molecular Formula C8H6F2O3