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Aniline and substituted anilines

Organic compounds that consist of a phenyl group attached to an amino group; aniline is the simplest aromatic amine. Anilines with additional substitutions are included.
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1 – 14 of 14 results
1

p-Anisidine-3-sulfonic Acid 98.0+%, TCI America™

CAS: 6470-17-3 Molecular Formula: C7H9NO4S Molecular Weight (g/mol): 203.212 MDL Number: MFCD00035760 InChI Key: JXZGTFLJFKLVAX-UHFFFAOYSA-N Synonym: 4-Aminoanisole-2-sulfonic Acid, 3-Amino-6-methoxybenzenesulfonic Acid, 4-Methoxyaniline-3-sulfonic Acid PubChem CID: 80945 IUPAC Name: 5-amino-2-methoxybenzenesulfonic acid SMILES: COC1=C(C=C(C=C1)N)S(=O)(=O)O

PubChem CID 80945
CAS 6470-17-3
Molecular Weight (g/mol) 203.212
MDL Number MFCD00035760
SMILES COC1=C(C=C(C=C1)N)S(=O)(=O)O
Synonym 4-Aminoanisole-2-sulfonic Acid, 3-Amino-6-methoxybenzenesulfonic Acid, 4-Methoxyaniline-3-sulfonic Acid
IUPAC Name 5-amino-2-methoxybenzenesulfonic acid
InChI Key JXZGTFLJFKLVAX-UHFFFAOYSA-N
Molecular Formula C7H9NO4S
2

o-Anisidine-5-sulfonic Acid 95.0+%, TCI America™

CAS: 98-42-0 Molecular Formula: C7H9NO4S Molecular Weight (g/mol): 203.212 MDL Number: MFCD00035759 InChI Key: FLIOATBXVNLPLK-UHFFFAOYSA-N Synonym: 4-methoxymetanilic acid,2-anisidine-4-sulfonic acid,2-methoxyaniline-5-sulfonic acid,benzenesulfonic acid, 3-amino-4-methoxy,o-anisidine-4-sulfonic acid,2-methoxy-5-sulfoaniline,o-anisidine-p-sulfonic acid,2-aminoanisole-4-sulfonic acid,benzenesulfonic acid, 3-amino-4-methoxyl,acmc-20ahhh PubChem CID: 66821 IUPAC Name: 3-amino-4-methoxybenzenesulfonic acid SMILES: COC1=C(C=C(C=C1)S(=O)(=O)O)N

PubChem CID 66821
CAS 98-42-0
Molecular Weight (g/mol) 203.212
MDL Number MFCD00035759
SMILES COC1=C(C=C(C=C1)S(=O)(=O)O)N
Synonym 4-methoxymetanilic acid,2-anisidine-4-sulfonic acid,2-methoxyaniline-5-sulfonic acid,benzenesulfonic acid, 3-amino-4-methoxy,o-anisidine-4-sulfonic acid,2-methoxy-5-sulfoaniline,o-anisidine-p-sulfonic acid,2-aminoanisole-4-sulfonic acid,benzenesulfonic acid, 3-amino-4-methoxyl,acmc-20ahhh
IUPAC Name 3-amino-4-methoxybenzenesulfonic acid
InChI Key FLIOATBXVNLPLK-UHFFFAOYSA-N
Molecular Formula C7H9NO4S
3

p-Anisidine-2-sulfonic Acid 97.0+%, TCI America™

CAS: 13244-33-2 Molecular Formula: C7H9NO4S Molecular Weight (g/mol): 203.212 MDL Number: MFCD00035804 InChI Key: KZKGEEGADAWJFS-UHFFFAOYSA-N Synonym: 4-aminoanisole-3-sulfonic acid,p-anisidine-3-sulfonic acid,benzenesulfonic acid, 2-amino-5-methoxy,4-methoxy-2-sulfoaniline,2-amino-5-methoxybenzenesulphonic acid,unii-hju535j932,2-amino-5-methoxybenzene-1-sulfonic acid,4-methoxyaniline-2-sulfonic acid,4-anisidine-2-sulfonicacid,2-amino-5-methoxy benzenesulfonic acid PubChem CID: 83260 IUPAC Name: 2-amino-5-methoxybenzenesulfonic acid SMILES: COC1=CC(=C(C=C1)N)S(=O)(=O)O

PubChem CID 83260
CAS 13244-33-2
Molecular Weight (g/mol) 203.212
MDL Number MFCD00035804
SMILES COC1=CC(=C(C=C1)N)S(=O)(=O)O
Synonym 4-aminoanisole-3-sulfonic acid,p-anisidine-3-sulfonic acid,benzenesulfonic acid, 2-amino-5-methoxy,4-methoxy-2-sulfoaniline,2-amino-5-methoxybenzenesulphonic acid,unii-hju535j932,2-amino-5-methoxybenzene-1-sulfonic acid,4-methoxyaniline-2-sulfonic acid,4-anisidine-2-sulfonicacid,2-amino-5-methoxy benzenesulfonic acid
IUPAC Name 2-amino-5-methoxybenzenesulfonic acid
InChI Key KZKGEEGADAWJFS-UHFFFAOYSA-N
Molecular Formula C7H9NO4S
4

N-(2,4-Dinitrophenyl)-6-aminohexanoic Acid 95.0+%, TCI America™

CAS: 10466-72-5 Molecular Formula: C12H15N3O6 Molecular Weight (g/mol): 297.27 MDL Number: MFCD00038470 InChI Key: ZYUWUKIAUDIXCQ-UHFFFAOYSA-N Synonym: N-Dnp-6-aminohexanoic Acid PubChem CID: 96812 ChEBI: CHEBI:53698 IUPAC Name: 6-[(2,4-dinitrophenyl)amino]hexanoic acid SMILES: OC(=O)CCCCCNC1=CC=C(C=C1[N+]([O-])=O)[N+]([O-])=O

PubChem CID 96812
CAS 10466-72-5
Molecular Weight (g/mol) 297.27
ChEBI CHEBI:53698
MDL Number MFCD00038470
SMILES OC(=O)CCCCCNC1=CC=C(C=C1[N+]([O-])=O)[N+]([O-])=O
Synonym N-Dnp-6-aminohexanoic Acid
IUPAC Name 6-[(2,4-dinitrophenyl)amino]hexanoic acid
InChI Key ZYUWUKIAUDIXCQ-UHFFFAOYSA-N
Molecular Formula C12H15N3O6
5

4-Amino-2-fluoro-5-methoxybenzeneboronic acid pinacol ester, 96%, Thermo Scientific Chemicals

CAS: 1326283-60-6 Molecular Formula: C13H19BFNO3 Molecular Weight (g/mol): 267.11 MDL Number: MFCD22419265 InChI Key: JWACNMHKJHEWAQ-UHFFFAOYSA-N Synonym: 4-amino-2-fluoro-5-methoxybenzeneboronic acid pinacol ester,5-fluoro-2-methoxy-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl aniline PubChem CID: 67363295 IUPAC Name: 5-fluoro-2-methoxy-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline SMILES: COC1=C(N)C=C(F)C(=C1)B1OC(C)(C)C(C)(C)O1

PubChem CID 67363295
CAS 1326283-60-6
Molecular Weight (g/mol) 267.11
MDL Number MFCD22419265
SMILES COC1=C(N)C=C(F)C(=C1)B1OC(C)(C)C(C)(C)O1
Synonym 4-amino-2-fluoro-5-methoxybenzeneboronic acid pinacol ester,5-fluoro-2-methoxy-4-4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl aniline
IUPAC Name 5-fluoro-2-methoxy-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline
InChI Key JWACNMHKJHEWAQ-UHFFFAOYSA-N
Molecular Formula C13H19BFNO3
6

2-Methoxyphenyl Isothiocyanate 98.0+%, TCI America™

CAS: 3288-04-8 Molecular Formula: C8H7NOS Molecular Weight (g/mol): 165.21 MDL Number: MFCD00011675 InChI Key: QKAOOWJWWKWWOZ-UHFFFAOYSA-N Synonym: 2-methoxyphenyl isothiocyanate,benzene, 1-isothiocyanato-2-methoxy,o-methoxyphenyl isothiocyanate,2-methoxyphenylisothiocyanate,1-isothiocyanato-2-methoxy-benzene,isothiocyanic acid 2-methoxyphenyl ester,2-methoxybenzenisothiocyanate,acmc-1coqu,o-methoxyphenylisothiocyanat,orthomethoxyphenyl isothiocyanate PubChem CID: 520599 IUPAC Name: 1-isothiocyanato-2-methoxybenzene SMILES: COC1=CC=CC=C1N=C=S

PubChem CID 520599
CAS 3288-04-8
Molecular Weight (g/mol) 165.21
MDL Number MFCD00011675
SMILES COC1=CC=CC=C1N=C=S
Synonym 2-methoxyphenyl isothiocyanate,benzene, 1-isothiocyanato-2-methoxy,o-methoxyphenyl isothiocyanate,2-methoxyphenylisothiocyanate,1-isothiocyanato-2-methoxy-benzene,isothiocyanic acid 2-methoxyphenyl ester,2-methoxybenzenisothiocyanate,acmc-1coqu,o-methoxyphenylisothiocyanat,orthomethoxyphenyl isothiocyanate
IUPAC Name 1-isothiocyanato-2-methoxybenzene
InChI Key QKAOOWJWWKWWOZ-UHFFFAOYSA-N
Molecular Formula C8H7NOS
7

3-Methoxyphenyl Isocyanate 97.0+%, TCI America™

CAS: 18908-07-1 Molecular Formula: C8H7NO2 Molecular Weight (g/mol): 149.149 MDL Number: MFCD00002019 InChI Key: NPOVTGVGOBJZPY-UHFFFAOYSA-N Synonym: 3-methoxyphenyl isocyanate,benzene, 1-isocyanato-3-methoxy,isocyanic acid 3-methoxyphenyl ester,3-isocyanatoanisole,3-methoxyphenylisocyanate,m-methoxyphenyl isocyanate,1-isocyanato-3-methoxy-benzene,3-methoxybenzenisocyanate,m-anisyl isocyanate,m-methoxyphenylisocyanate PubChem CID: 87843 IUPAC Name: 1-isocyanato-3-methoxybenzene SMILES: COC1=CC=CC(=C1)N=C=O

PubChem CID 87843
CAS 18908-07-1
Molecular Weight (g/mol) 149.149
MDL Number MFCD00002019
SMILES COC1=CC=CC(=C1)N=C=O
Synonym 3-methoxyphenyl isocyanate,benzene, 1-isocyanato-3-methoxy,isocyanic acid 3-methoxyphenyl ester,3-isocyanatoanisole,3-methoxyphenylisocyanate,m-methoxyphenyl isocyanate,1-isocyanato-3-methoxy-benzene,3-methoxybenzenisocyanate,m-anisyl isocyanate,m-methoxyphenylisocyanate
IUPAC Name 1-isocyanato-3-methoxybenzene
InChI Key NPOVTGVGOBJZPY-UHFFFAOYSA-N
Molecular Formula C8H7NO2
8

2-Methoxyphenyl Isocyanate 98.0+%, TCI America™

CAS: 700-87-8 Molecular Formula: C8H7NO2 Molecular Weight (g/mol): 149.15 MDL Number: MFCD00002004 InChI Key: SUVCZZADQDCIEQ-UHFFFAOYSA-N Synonym: 2-methoxyphenyl isocyanate,2-methoxyphenylisocyanate,benzene, 1-isocyanato-2-methoxy,o-methoxyphenyl isocyanate,2-isocyanatoanisole,1-isocyanato-2-methoxy-benzene,o-anisylisocyanate,2-methoxybenzenisocyanate,o-anisyl isocyanate,methoxyphenyl isocyanate PubChem CID: 69695 IUPAC Name: 1-isocyanato-2-methoxybenzene SMILES: COC1=CC=CC=C1N=C=O

PubChem CID 69695
CAS 700-87-8
Molecular Weight (g/mol) 149.15
MDL Number MFCD00002004
SMILES COC1=CC=CC=C1N=C=O
Synonym 2-methoxyphenyl isocyanate,2-methoxyphenylisocyanate,benzene, 1-isocyanato-2-methoxy,o-methoxyphenyl isocyanate,2-isocyanatoanisole,1-isocyanato-2-methoxy-benzene,o-anisylisocyanate,2-methoxybenzenisocyanate,o-anisyl isocyanate,methoxyphenyl isocyanate
IUPAC Name 1-isocyanato-2-methoxybenzene
InChI Key SUVCZZADQDCIEQ-UHFFFAOYSA-N
Molecular Formula C8H7NO2
10

4-Methoxyphenyl Isocyanate 98.0+%, TCI America™

CAS: 5416-93-3 Molecular Formula: C8H7NO2 Molecular Weight (g/mol): 149.149 MDL Number: MFCD00002026 InChI Key: FMDGXCSMDZMDHZ-UHFFFAOYSA-N Synonym: 4-methoxyphenyl isocyanate,4-methoxyphenylisocyanate,benzene, 1-isocyanato-4-methoxy,p-anisyl isocyanate,p-methoxyphenyl isocyanate,isocyanic acid, p-methoxyphenyl ester,unii-c50o5096nc,1-isocyanato-4-methoxy-benzene,4-methoxybenzenisocyanate,4-methoxyisocyanatobenzene PubChem CID: 79443 IUPAC Name: 1-isocyanato-4-methoxybenzene SMILES: COC1=CC=C(C=C1)N=C=O

PubChem CID 79443
CAS 5416-93-3
Molecular Weight (g/mol) 149.149
MDL Number MFCD00002026
SMILES COC1=CC=C(C=C1)N=C=O
Synonym 4-methoxyphenyl isocyanate,4-methoxyphenylisocyanate,benzene, 1-isocyanato-4-methoxy,p-anisyl isocyanate,p-methoxyphenyl isocyanate,isocyanic acid, p-methoxyphenyl ester,unii-c50o5096nc,1-isocyanato-4-methoxy-benzene,4-methoxybenzenisocyanate,4-methoxyisocyanatobenzene
IUPAC Name 1-isocyanato-4-methoxybenzene
InChI Key FMDGXCSMDZMDHZ-UHFFFAOYSA-N
Molecular Formula C8H7NO2
11

Methyl 4-Amino-3-bromobenzoate 98.0+%, TCI America™

CAS: 106896-49-5 Molecular Formula: C8H8BrNO2 Molecular Weight (g/mol): 230.06 MDL Number: MFCD01861385 InChI Key: AIUWAOALZYWQBX-UHFFFAOYSA-N Synonym: 4-amino-3-bromo-benzoic acid methyl ester,methyl4-amino-3-bromobenzoate,2-bromo-4-methoxycarbonylaniline,benzoic acid, 4-amino-3-bromo-, methyl ester,4-amino-3-bromobenzoic acid methyl ester,acmc-2098mp,methyl-4-amino-3-bromobenzoate,methyl 4-amino-3-bromo-benzoate,timtec-bb sbb012847,2-bromo-4-methoxycarbonyl aniline PubChem CID: 1515280 IUPAC Name: methyl 4-amino-3-bromobenzoate SMILES: COC(=O)C1=CC=C(N)C(Br)=C1

PubChem CID 1515280
CAS 106896-49-5
Molecular Weight (g/mol) 230.06
MDL Number MFCD01861385
SMILES COC(=O)C1=CC=C(N)C(Br)=C1
Synonym 4-amino-3-bromo-benzoic acid methyl ester,methyl4-amino-3-bromobenzoate,2-bromo-4-methoxycarbonylaniline,benzoic acid, 4-amino-3-bromo-, methyl ester,4-amino-3-bromobenzoic acid methyl ester,acmc-2098mp,methyl-4-amino-3-bromobenzoate,methyl 4-amino-3-bromo-benzoate,timtec-bb sbb012847,2-bromo-4-methoxycarbonyl aniline
IUPAC Name methyl 4-amino-3-bromobenzoate
InChI Key AIUWAOALZYWQBX-UHFFFAOYSA-N
Molecular Formula C8H8BrNO2
12

Sodium 3-(N-Ethyl-3-methoxyanilino)-2-hydroxy-1-propanesulfonate 98.0+%, TCI America™

CAS: 82692-96-4 Molecular Formula: C12H22NNaO7S Molecular Weight (g/mol): 347.36 MDL Number: MFCD09261431 InChI Key: PNGLEYLFMHGIQO-UHFFFAOYNA-M Synonym: 3-(N-Ethyl-3-methoxyanilino)-2-hydroxy-1-propanesulfonic Acid Sodium Salt, N-Ethyl-N-(2-hydroxy-3-sulfopropyl)-3-methoxyaniline Sodium Salt, ADOS PubChem CID: 71307074 IUPAC Name: sodium 3-[ethyl(3-methoxyphenyl)amino]-2-hydroxypropane-1-sulfonate dihydrate SMILES: O.O.[Na+].CCN(CC(O)CS([O-])(=O)=O)C1=CC(OC)=CC=C1

PubChem CID 71307074
CAS 82692-96-4
Molecular Weight (g/mol) 347.36
MDL Number MFCD09261431
SMILES O.O.[Na+].CCN(CC(O)CS([O-])(=O)=O)C1=CC(OC)=CC=C1
Synonym 3-(N-Ethyl-3-methoxyanilino)-2-hydroxy-1-propanesulfonic Acid Sodium Salt, N-Ethyl-N-(2-hydroxy-3-sulfopropyl)-3-methoxyaniline Sodium Salt, ADOS
IUPAC Name sodium 3-[ethyl(3-methoxyphenyl)amino]-2-hydroxypropane-1-sulfonate dihydrate
InChI Key PNGLEYLFMHGIQO-UHFFFAOYNA-M
Molecular Formula C12H22NNaO7S
14

Methyl 4-Amino-2-methoxybenzoate 98.0+%, TCI America™

CAS: 27492-84-8 Molecular Formula: C9H11NO3 Molecular Weight (g/mol): 181.19 MDL Number: MFCD00017202 InChI Key: YUPQMVSYNJQULF-UHFFFAOYSA-N Synonym: methyl 4-amino-o-anisate,4-amino-2-methoxybenzoic acid methyl ester,benzoic acid, 4-amino-2-methoxy-, methyl ester,methyl 2-methoxy-4-aminobenzoate,methyl 4-amino-2-methoxy-benzoate,4-amino-o-anisic acid methyl ester,methyl 4-amino-2-methoxybenzenecarboxylate,2-methoxy-4-aminobenzoic acid methyl ester,ethylbenzyl dimethyltetradecylammonium chloride,pubchem4712 PubChem CID: 168705 IUPAC Name: methyl 4-amino-2-methoxybenzoate SMILES: COC(=O)C1=CC=C(N)C=C1OC

PubChem CID 168705
CAS 27492-84-8
Molecular Weight (g/mol) 181.19
MDL Number MFCD00017202
SMILES COC(=O)C1=CC=C(N)C=C1OC
Synonym methyl 4-amino-o-anisate,4-amino-2-methoxybenzoic acid methyl ester,benzoic acid, 4-amino-2-methoxy-, methyl ester,methyl 2-methoxy-4-aminobenzoate,methyl 4-amino-2-methoxy-benzoate,4-amino-o-anisic acid methyl ester,methyl 4-amino-2-methoxybenzenecarboxylate,2-methoxy-4-aminobenzoic acid methyl ester,ethylbenzyl dimethyltetradecylammonium chloride,pubchem4712
IUPAC Name methyl 4-amino-2-methoxybenzoate
InChI Key YUPQMVSYNJQULF-UHFFFAOYSA-N
Molecular Formula C9H11NO3