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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 – 15 of 21 results
1

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
2

1-(4-Methoxyphenyl)-5-methyl-1H-pyrazole-4-carboxylic acid, 97%, Thermo Scientific™

CAS: 187998-64-7 Molecular Formula: C12H12N2O3 Molecular Weight (g/mol): 232.239 MDL Number: MFCD02677745 InChI Key: JPFGKGZYCXLEGQ-UHFFFAOYSA-N PubChem CID: 2776133 IUPAC Name: 1-(4-methoxyphenyl)-5-methylpyrazole-4-carboxylic acid SMILES: CC1=C(C=NN1C2=CC=C(C=C2)OC)C(=O)O

PubChem CID 2776133
CAS 187998-64-7
Molecular Weight (g/mol) 232.239
MDL Number MFCD02677745
SMILES CC1=C(C=NN1C2=CC=C(C=C2)OC)C(=O)O
IUPAC Name 1-(4-methoxyphenyl)-5-methylpyrazole-4-carboxylic acid
InChI Key JPFGKGZYCXLEGQ-UHFFFAOYSA-N
Molecular Formula C12H12N2O3
3

Methyl 4-amino-2-methoxybenzoate, 98%, Thermo Scientific Chemicals

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
4

Methyl 4-amino-3-bromobenzoate, 97%

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
6

o-Dianisidine dihydrochloride, 98%

CAS: 20325-40-0 Molecular Formula: C14H18Cl2N2O2 Molecular Weight (g/mol): 317.21 MDL Number: MFCD00012488 InChI Key: UXTIAFYTYOEQHV-UHFFFAOYSA-N Synonym: 3,3'-dimethoxybenzidine dihydrochloride,o-dianisidine dihydrochloride,3,3'-dimethoxy-1,1'-biphenyl-4,4'-diamine dihydrochloride,unii-qv96qa6ukk,dianisidine dihydrochloride,ccris 998,o-dianisidine hcl,qv96qa6ukk,c.i. disperse black 6 dihydrochloride PubChem CID: 62311 IUPAC Name: 4-(4-amino-3-methoxyphenyl)-2-methoxyaniline;dihydrochloride SMILES: COC1=C(C=CC(=C1)C2=CC(=C(C=C2)N)OC)N.Cl.Cl

PubChem CID 62311
CAS 20325-40-0
Molecular Weight (g/mol) 317.21
MDL Number MFCD00012488
SMILES COC1=C(C=CC(=C1)C2=CC(=C(C=C2)N)OC)N.Cl.Cl
Synonym 3,3'-dimethoxybenzidine dihydrochloride,o-dianisidine dihydrochloride,3,3'-dimethoxy-1,1'-biphenyl-4,4'-diamine dihydrochloride,unii-qv96qa6ukk,dianisidine dihydrochloride,ccris 998,o-dianisidine hcl,qv96qa6ukk,c.i. disperse black 6 dihydrochloride
IUPAC Name 4-(4-amino-3-methoxyphenyl)-2-methoxyaniline;dihydrochloride
InChI Key UXTIAFYTYOEQHV-UHFFFAOYSA-N
Molecular Formula C14H18Cl2N2O2
7

o-Anisidine, 99%

CAS: 90-04-0 Molecular Formula: C7H9NO Molecular Weight (g/mol): 123.155 MDL Number: MFCD00007688 InChI Key: VMPITZXILSNTON-UHFFFAOYSA-N Synonym: o-anisidine,2-anisidine,ortho-anisidine,2-aminoanisole,o-methoxyaniline,o-aminoanisole,benzenamine, 2-methoxy,2-methoxybenzenamine,o-methoxyphenylamine,o-anisylamine PubChem CID: 7000 ChEBI: CHEBI:82288 IUPAC Name: 2-methoxyaniline SMILES: COC1=CC=CC=C1N

PubChem CID 7000
CAS 90-04-0
Molecular Weight (g/mol) 123.155
ChEBI CHEBI:82288
MDL Number MFCD00007688
SMILES COC1=CC=CC=C1N
Synonym o-anisidine,2-anisidine,ortho-anisidine,2-aminoanisole,o-methoxyaniline,o-aminoanisole,benzenamine, 2-methoxy,2-methoxybenzenamine,o-methoxyphenylamine,o-anisylamine
IUPAC Name 2-methoxyaniline
InChI Key VMPITZXILSNTON-UHFFFAOYSA-N
Molecular Formula C7H9NO
8

2-Methoxyphenyl isothiocyanate, 98%

CAS: 3288-04-8 MDL Number: MFCD00011675

CAS 3288-04-8
MDL Number MFCD00011675
9

4-Methoxyphenyl isothiocyanate, 98%

CAS: 2284-20-0 Molecular Formula: C8H7NOS Molecular Weight (g/mol): 165.21 MDL Number: MFCD00011676 InChI Key: VRPQCVLBOZOYCG-UHFFFAOYSA-N Synonym: 4-methoxyphenyl isothiocyanate,4-methoxyphenylisothiocyanate,1-isothiocyanato-4-methoxy-benzene,p-methoxyphenyl isothiocyanate,benzene, 1-isothiocyanato-4-methoxy,isothiocyanic acid 4-methoxyphenyl ester,4-methoxybenzenisothiocyanate,4-isothiocyanatoanisole,acmc-1ccqx,p-methoxyphenylisothiocyanate PubChem CID: 75293 IUPAC Name: 1-isothiocyanato-4-methoxybenzene SMILES: COC1=CC=C(C=C1)N=C=S

PubChem CID 75293
CAS 2284-20-0
Molecular Weight (g/mol) 165.21
MDL Number MFCD00011676
SMILES COC1=CC=C(C=C1)N=C=S
Synonym 4-methoxyphenyl isothiocyanate,4-methoxyphenylisothiocyanate,1-isothiocyanato-4-methoxy-benzene,p-methoxyphenyl isothiocyanate,benzene, 1-isothiocyanato-4-methoxy,isothiocyanic acid 4-methoxyphenyl ester,4-methoxybenzenisothiocyanate,4-isothiocyanatoanisole,acmc-1ccqx,p-methoxyphenylisothiocyanate
IUPAC Name 1-isothiocyanato-4-methoxybenzene
InChI Key VRPQCVLBOZOYCG-UHFFFAOYSA-N
Molecular Formula C8H7NOS
10

3-Methoxyphenyl isocyanate, 99%

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
11

4-Methoxyphenyl isocyanate, 98%

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
12

m-Anisidine, 99%

CAS: 536-90-3 Molecular Formula: C7H9NO Molecular Weight (g/mol): 123.15 MDL Number: MFCD00007783 InChI Key: NCBZRJODKRCREW-UHFFFAOYSA-N Synonym: m-anisidine,3-aminoanisole,m-methoxyaniline,3-methoxybenzenamine,3-anisidine,m-aminoanisole,benzenamine, 3-methoxy,m-anisylamine,1-amino-3-methoxybenzene,unii-jxa144kx2i PubChem CID: 10824 IUPAC Name: 3-methoxyaniline SMILES: COC1=CC=CC(=C1)N

PubChem CID 10824
CAS 536-90-3
Molecular Weight (g/mol) 123.15
MDL Number MFCD00007783
SMILES COC1=CC=CC(=C1)N
Synonym m-anisidine,3-aminoanisole,m-methoxyaniline,3-methoxybenzenamine,3-anisidine,m-aminoanisole,benzenamine, 3-methoxy,m-anisylamine,1-amino-3-methoxybenzene,unii-jxa144kx2i
IUPAC Name 3-methoxyaniline
InChI Key NCBZRJODKRCREW-UHFFFAOYSA-N
Molecular Formula C7H9NO
13

3-Methoxyphenyl isocyanate, 99%

CAS: 18908-07-1 Molecular Formula: C8H7NO2 Molecular Weight (g/mol): 149.15 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) 149.15
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
14

4-Methoxyphenyl isocyanate, 99%

CAS: 5416-93-3 Molecular Formula: C8H7NO2 Molecular Weight (g/mol): 149.15 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) 149.15
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
15

o-Anisidine, 98+%

CAS: 90-04-0 Molecular Formula: C7H9NO Molecular Weight (g/mol): 123.15 MDL Number: MFCD00007688 InChI Key: VMPITZXILSNTON-UHFFFAOYSA-N Synonym: o-anisidine,2-anisidine,ortho-anisidine,2-aminoanisole,o-methoxyaniline,o-aminoanisole,benzenamine, 2-methoxy,2-methoxybenzenamine,o-methoxyphenylamine,o-anisylamine PubChem CID: 7000 ChEBI: CHEBI:82288 IUPAC Name: 2-methoxyaniline SMILES: COC1=CC=CC=C1N

PubChem CID 7000
CAS 90-04-0
Molecular Weight (g/mol) 123.15
ChEBI CHEBI:82288
MDL Number MFCD00007688
SMILES COC1=CC=CC=C1N
Synonym o-anisidine,2-anisidine,ortho-anisidine,2-aminoanisole,o-methoxyaniline,o-aminoanisole,benzenamine, 2-methoxy,2-methoxybenzenamine,o-methoxyphenylamine,o-anisylamine
IUPAC Name 2-methoxyaniline
InChI Key VMPITZXILSNTON-UHFFFAOYSA-N
Molecular Formula C7H9NO