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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Thermo Scientific Chemicals Nitro Blue Tetrazolium Chloride, 90%

CAS: 298-83-9 Molecular Formula: C₄₀H₃₀Cl₂N₁₀O₆ Molecular Weight (g/mol): 817.65 InChI Key: FSVCQIDHPKZJSO-UHFFFAOYSA-L Synonym: nitrotetrazolium blue chloride,nitro bt,nitro blue tetrazolium,nbt,nitro blue tetrazolium chloride,p-nitrotetrazolium blue,nitrotetrazolium blue,nitroblue tetrazolium chloride,p-nitro blue tetrazolium chloride,nitro tetrazolium bt PubChem CID: 9281 ChEBI: CHEBI:9505 IUPAC Name: 2-[2-methoxy-4-[3-methoxy-4-[3-(4-nitrophenyl)-5-phenyltetrazol-2-ium-2-yl]phenyl]phenyl]-3-(4-nitrophenyl)-5-phenyltetrazol-2-ium;dichloride SMILES: COC1=C(C=CC(=C1)C2=CC(=C(C=C2)[N+]3=NC(=NN3C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=CC=C5)OC)[N+]6=NC(=NN6C7=CC=C(C=C7)[N+](=O)[O-])C8=CC=CC=C8.[Cl-].[Cl-]

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Specifications

PubChem CID	9281
CAS	298-83-9
Molecular Weight (g/mol)	817.65
ChEBI	CHEBI:9505
SMILES	COC1=C(C=CC(=C1)C2=CC(=C(C=C2)[N+]3=NC(=NN3C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=CC=C5)OC)[N+]6=NC(=NN6C7=CC=C(C=C7)[N+](=O)[O-])C8=CC=CC=C8.[Cl-].[Cl-]
Synonym	nitrotetrazolium blue chloride,nitro bt,nitro blue tetrazolium,nbt,nitro blue tetrazolium chloride,p-nitrotetrazolium blue,nitrotetrazolium blue,nitroblue tetrazolium chloride,p-nitro blue tetrazolium chloride,nitro tetrazolium bt
IUPAC Name	2-[2-methoxy-4-[3-methoxy-4-[3-(4-nitrophenyl)-5-phenyltetrazol-2-ium-2-yl]phenyl]phenyl]-3-(4-nitrophenyl)-5-phenyltetrazol-2-ium;dichloride
InChI Key	FSVCQIDHPKZJSO-UHFFFAOYSA-L
Molecular Formula	C₄₀H₃₀Cl₂N₁₀O₆

2,4-Dichloro-5-methoxyaniline, 98%

CAS: 98446-49-2 Molecular Formula: C7H7Cl2NO Molecular Weight (g/mol): 192.039 MDL Number: MFCD00974410 InChI Key: AJROJTARXSATEB-UHFFFAOYSA-N Synonym: 5-amino-2,4-dichloroanisole,2,4-dichloro-5-methoxybenzenamine,4,6-dichloro-m-anisidine,2,4-dichloro-5-methoxy-phenylamine,benzenamine, 2,4-dichloro-5-methoxy,2,4-dichloro-5-methoxyphenylamine,dichloromethoxyaniline,pubchem4393,acmc-209sae,4,5-dichloro-m-anisidine PubChem CID: 1476636 IUPAC Name: 2,4-dichloro-5-methoxyaniline SMILES: COC1=C(C=C(C(=C1)N)Cl)Cl

Pricing and Availability
Specifications

PubChem CID	1476636
CAS	98446-49-2
Molecular Weight (g/mol)	192.039
MDL Number	MFCD00974410
SMILES	COC1=C(C=C(C(=C1)N)Cl)Cl
Synonym	5-amino-2,4-dichloroanisole,2,4-dichloro-5-methoxybenzenamine,4,6-dichloro-m-anisidine,2,4-dichloro-5-methoxy-phenylamine,benzenamine, 2,4-dichloro-5-methoxy,2,4-dichloro-5-methoxyphenylamine,dichloromethoxyaniline,pubchem4393,acmc-209sae,4,5-dichloro-m-anisidine
IUPAC Name	2,4-dichloro-5-methoxyaniline
InChI Key	AJROJTARXSATEB-UHFFFAOYSA-N
Molecular Formula	C7H7Cl2NO

3-Methoxyphenyl isothiocyanate, 98%

CAS: 3125-64-2 Molecular Formula: C8H7NOS Molecular Weight (g/mol): 165.21 MDL Number: MFCD00040335 InChI Key: WHBYCPUKGYEYFU-UHFFFAOYSA-N Synonym: 3-methoxyphenyl isothiocyanate,3-methoxyphenylisothiocyanate,1-isothiocyanato-3-methoxy-benzene,3-isothiocyanatoanisole,acmc-1cldj,m-methoxyphenyl isothiocyanate,3-methoxy phenyl isothiocyanate,3-methoxy-phenyl isothiocyanate,# PubChem CID: 137832 IUPAC Name: 1-isothiocyanato-3-methoxybenzene SMILES: COC1=CC=CC(=C1)N=C=S

Pricing and Availability
Specifications

PubChem CID	137832
CAS	3125-64-2
Molecular Weight (g/mol)	165.21
MDL Number	MFCD00040335
SMILES	COC1=CC=CC(=C1)N=C=S
Synonym	3-methoxyphenyl isothiocyanate,3-methoxyphenylisothiocyanate,1-isothiocyanato-3-methoxy-benzene,3-isothiocyanatoanisole,acmc-1cldj,m-methoxyphenyl isothiocyanate,3-methoxy phenyl isothiocyanate,3-methoxy-phenyl isothiocyanate,#
IUPAC Name	1-isothiocyanato-3-methoxybenzene
InChI Key	WHBYCPUKGYEYFU-UHFFFAOYSA-N
Molecular Formula	C8H7NOS

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

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Specifications

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

2-Methoxyphenyl isothiocyanate, 98%

CAS: 3288-04-8 MDL Number: MFCD00011675

Pricing and Availability
Specifications

CAS	3288-04-8
MDL Number	MFCD00011675

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

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Specifications

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

N-(4-Fluorobenzyl)-4-methoxyaniline, 97%, Thermo Scientific™

CAS: 356531-43-6 Molecular Formula: C14H14FNO Molecular Weight (g/mol): 231.27 MDL Number: MFCD03210757 InChI Key: QHNUQKUZGHGTCA-UHFFFAOYSA-N Synonym: n-4-fluorobenzyl-4-methoxyaniline,n-4-fluorophenyl methyl-4-methoxyaniline,n-4-methoxyphenyl-4-fluorobenzenemethanamine PubChem CID: 964317 IUPAC Name: N-[(4-fluorophenyl)methyl]-4-methoxyaniline SMILES: COC1=CC=C(C=C1)NCC2=CC=C(C=C2)F

Pricing and Availability
Specifications

PubChem CID	964317
CAS	356531-43-6
Molecular Weight (g/mol)	231.27
MDL Number	MFCD03210757
SMILES	COC1=CC=C(C=C1)NCC2=CC=C(C=C2)F
Synonym	n-4-fluorobenzyl-4-methoxyaniline,n-4-fluorophenyl methyl-4-methoxyaniline,n-4-methoxyphenyl-4-fluorobenzenemethanamine
IUPAC Name	N-[(4-fluorophenyl)methyl]-4-methoxyaniline
InChI Key	QHNUQKUZGHGTCA-UHFFFAOYSA-N
Molecular Formula	C14H14FNO

6-Methoxy-8-nitroquinoline, 99%, Thermo Scientific™

CAS: 85-81-4 Molecular Formula: C₁₀H₈N₂O₃ Molecular Weight (g/mol): 204.18 MDL Number: MFCD00006802 InChI Key: MIMUSZHMZBJBPO-UHFFFAOYSA-N Synonym: quinoline, 6-methoxy-8-nitro,6-methoxy-8-nitro-quinoline,8-nitro-6-methoxyquinoline,methyl 8-nitro-6-quinolyl ether,unii-ats412o1xo,ats412o1xo,pubchem9433,acmc-209q7l,5-21-03-00248 beilstein handbook reference,ksc655o7n PubChem CID: 6822 IUPAC Name: 6-methoxy-8-nitroquinoline SMILES: COC1=CC(=C2C(=C1)C=CC=N2)[N+](=O)[O-]

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Specifications

PubChem CID	6822
CAS	85-81-4
Molecular Weight (g/mol)	204.18
MDL Number	MFCD00006802
SMILES	COC1=CC(=C2C(=C1)C=CC=N2)[N+](=O)[O-]
Synonym	quinoline, 6-methoxy-8-nitro,6-methoxy-8-nitro-quinoline,8-nitro-6-methoxyquinoline,methyl 8-nitro-6-quinolyl ether,unii-ats412o1xo,ats412o1xo,pubchem9433,acmc-209q7l,5-21-03-00248 beilstein handbook reference,ksc655o7n
IUPAC Name	6-methoxy-8-nitroquinoline
InChI Key	MIMUSZHMZBJBPO-UHFFFAOYSA-N
Molecular Formula	C₁₀H₈N₂O₃

2-Bromo-N-methylaniline, 95%

CAS: 6832-87-7 Molecular Formula: C7H8BrN Molecular Weight (g/mol): 186.052 MDL Number: MFCD06798064 InChI Key: SMVIAQFTVWDWDS-UHFFFAOYSA-N PubChem CID: 334086 IUPAC Name: 2-bromo-N-methylaniline SMILES: CNC1=CC=CC=C1Br

Pricing and Availability
Specifications

PubChem CID	334086
CAS	6832-87-7
Molecular Weight (g/mol)	186.052
MDL Number	MFCD06798064
SMILES	CNC1=CC=CC=C1Br
IUPAC Name	2-bromo-N-methylaniline
InChI Key	SMVIAQFTVWDWDS-UHFFFAOYSA-N
Molecular Formula	C7H8BrN

4,4'-Dimethoxydiphenylamine, 98%

CAS: 101-70-2 Molecular Formula: C14H15NO2 Molecular Weight (g/mol): 229.28 MDL Number: MFCD00014895 InChI Key: VCOONNWIINSFBA-UHFFFAOYSA-N Synonym: bis 4-methoxyphenyl amine,4,4'-dimethoxydiphenylamine,di-p-anisylamine,di-p-methoxyphenylamine,4-methoxy-n-4-methoxyphenyl aniline,bis p-anisyl amine,bis p-methoxyphenyl amine,benzenamine, 4-methoxy-n-4-methoxyphenyl,termofleks a,bis-4-methoxy-phenyl-amine PubChem CID: 7571 IUPAC Name: 4-methoxy-N-(4-methoxyphenyl)aniline SMILES: COC1=CC=C(NC2=CC=C(OC)C=C2)C=C1

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Specifications

PubChem CID	7571
CAS	101-70-2
Molecular Weight (g/mol)	229.28
MDL Number	MFCD00014895
SMILES	COC1=CC=C(NC2=CC=C(OC)C=C2)C=C1
Synonym	bis 4-methoxyphenyl amine,4,4'-dimethoxydiphenylamine,di-p-anisylamine,di-p-methoxyphenylamine,4-methoxy-n-4-methoxyphenyl aniline,bis p-anisyl amine,bis p-methoxyphenyl amine,benzenamine, 4-methoxy-n-4-methoxyphenyl,termofleks a,bis-4-methoxy-phenyl-amine
IUPAC Name	4-methoxy-N-(4-methoxyphenyl)aniline
InChI Key	VCOONNWIINSFBA-UHFFFAOYSA-N
Molecular Formula	C14H15NO2

2-Chloro-5-methoxyaniline, 98+%

CAS: 2401-24-3 Molecular Formula: C7H8ClNO Molecular Weight (g/mol): 157.597 MDL Number: MFCD00047830 InChI Key: GBOUQGUQUUPGLO-UHFFFAOYSA-N Synonym: 6-chloro-m-anisidine,3-amino-4-chloroanisole,benzenamine, 2-chloro-5-methoxy,2-chloro-5-methoxy-aniline,6-chloro-m-anisidine hydrochloride,2-chloro-5-methoxy-phenylamine,2-chloro-5-methoxybenzenamine hydrochloride,6-chloro-meta-anisidine hydrochloride,2-chloro-5-methoxyanilinehydrochloride,timtec-bb sbb008038 PubChem CID: 75460 IUPAC Name: 2-chloro-5-methoxyaniline SMILES: COC1=CC(=C(C=C1)Cl)N

Pricing and Availability
Specifications

PubChem CID	75460
CAS	2401-24-3
Molecular Weight (g/mol)	157.597
MDL Number	MFCD00047830
SMILES	COC1=CC(=C(C=C1)Cl)N
Synonym	6-chloro-m-anisidine,3-amino-4-chloroanisole,benzenamine, 2-chloro-5-methoxy,2-chloro-5-methoxy-aniline,6-chloro-m-anisidine hydrochloride,2-chloro-5-methoxy-phenylamine,2-chloro-5-methoxybenzenamine hydrochloride,6-chloro-meta-anisidine hydrochloride,2-chloro-5-methoxyanilinehydrochloride,timtec-bb sbb008038
IUPAC Name	2-chloro-5-methoxyaniline
InChI Key	GBOUQGUQUUPGLO-UHFFFAOYSA-N
Molecular Formula	C7H8ClNO

2-Bromo-3-fluoroaniline, 97%

CAS: 111721-75-6 Molecular Formula: C6H5BrFN Molecular Weight (g/mol): 190.015 MDL Number: MFCD07369915 InChI Key: XZRSXRUYZXBTGD-UHFFFAOYSA-N Synonym: 2-bromo-3-fluorophenylamine,2-bromo-3-fluoro-phenylamine,2-bromo-3-fluorobenzenamine,benzenamine, 2-bromo-3-fluoro,pubchem1523,acmc-1c6kb,2-bromo-3-fluoro-aniline,ksc493i1t,2-bromo-3-fluoro-phenyl-amine PubChem CID: 14770005 IUPAC Name: 2-bromo-3-fluoroaniline SMILES: C1=CC(=C(C(=C1)F)Br)N

Pricing and Availability
Specifications

PubChem CID	14770005
CAS	111721-75-6
Molecular Weight (g/mol)	190.015
MDL Number	MFCD07369915
SMILES	C1=CC(=C(C(=C1)F)Br)N
Synonym	2-bromo-3-fluorophenylamine,2-bromo-3-fluoro-phenylamine,2-bromo-3-fluorobenzenamine,benzenamine, 2-bromo-3-fluoro,pubchem1523,acmc-1c6kb,2-bromo-3-fluoro-aniline,ksc493i1t,2-bromo-3-fluoro-phenyl-amine
IUPAC Name	2-bromo-3-fluoroaniline
InChI Key	XZRSXRUYZXBTGD-UHFFFAOYSA-N
Molecular Formula	C6H5BrFN

4-Chloro-3-methoxyaniline, 98%

CAS: 13726-14-2 Molecular Formula: C7H8ClNO Molecular Weight (g/mol): 157.60 MDL Number: MFCD00672967 InChI Key: LNKBDFVSILQKSI-UHFFFAOYSA-N Synonym: 3-methoxy-4-chloroaniline,4-chloro-3-methoxyphenylamine,4-chloro-m-anisidine,2-chloro-5-aminoanisole,5-amino-2-chloroanisole,4-chloro-3-methoxy aniline,4-chloro-3-methoxy-phenylamine,benzenamine, 4-chloro-3-methoxy,pubchem3659,acmc-1chua PubChem CID: 13103692 IUPAC Name: 4-chloro-3-methoxyaniline SMILES: COC1=C(Cl)C=CC(N)=C1

Pricing and Availability
Specifications

PubChem CID	13103692
CAS	13726-14-2
Molecular Weight (g/mol)	157.60
MDL Number	MFCD00672967
SMILES	COC1=C(Cl)C=CC(N)=C1
Synonym	3-methoxy-4-chloroaniline,4-chloro-3-methoxyphenylamine,4-chloro-m-anisidine,2-chloro-5-aminoanisole,5-amino-2-chloroanisole,4-chloro-3-methoxy aniline,4-chloro-3-methoxy-phenylamine,benzenamine, 4-chloro-3-methoxy,pubchem3659,acmc-1chua
IUPAC Name	4-chloro-3-methoxyaniline
InChI Key	LNKBDFVSILQKSI-UHFFFAOYSA-N
Molecular Formula	C7H8ClNO

4-Bromo-5-fluoro-2-methoxyaniline, 96%, Thermo Scientific Chemicals

CAS: 330794-03-1 Molecular Formula: C7H7BrFNO Molecular Weight (g/mol): 220.04 MDL Number: MFCD21603958 InChI Key: WOFOKKKWMDHLEX-UHFFFAOYSA-N Synonym: benzenamine, 4-bromo-5-fluoro-2-methoxy PubChem CID: 22347298 IUPAC Name: 4-bromo-5-fluoro-2-methoxyaniline SMILES: COC1=CC(Br)=C(F)C=C1N

Pricing and Availability
Specifications

PubChem CID	22347298
CAS	330794-03-1
Molecular Weight (g/mol)	220.04
MDL Number	MFCD21603958
SMILES	COC1=CC(Br)=C(F)C=C1N
Synonym	benzenamine, 4-bromo-5-fluoro-2-methoxy
IUPAC Name	4-bromo-5-fluoro-2-methoxyaniline
InChI Key	WOFOKKKWMDHLEX-UHFFFAOYSA-N
Molecular Formula	C7H7BrFNO

2-Methoxy-5-methylphenyl isocyanate, 97%

CAS: 59741-04-7 Molecular Formula: C9H9NO2 Molecular Weight (g/mol): 163.176 MDL Number: MFCD00013869 InChI Key: IDOHLSFNBKNRRJ-UHFFFAOYSA-N Synonym: 2-methoxy-5-methylphenyl isocyanate,2-methoxy-5-methylphenylisocyanate,2-isocyanato-1-methoxy-4-methyl-benzene,benzene, 2-isocyanato-1-methoxy-4-methyl,acmc-20anrw,2-methoxy-5-methylbenzenisocyanate,2-methoxy-5-methylpheny lisocyanate,2-isocyanato-1-methyloxy-4-methylbenzene,benzene, 2-isocyanato-1-methoxy-4-methyl-9ci PubChem CID: 4141520 IUPAC Name: 2-isocyanato-1-methoxy-4-methylbenzene SMILES: CC1=CC(=C(C=C1)OC)N=C=O

Pricing and Availability
Specifications

PubChem CID	4141520
CAS	59741-04-7
Molecular Weight (g/mol)	163.176
MDL Number	MFCD00013869
SMILES	CC1=CC(=C(C=C1)OC)N=C=O
Synonym	2-methoxy-5-methylphenyl isocyanate,2-methoxy-5-methylphenylisocyanate,2-isocyanato-1-methoxy-4-methyl-benzene,benzene, 2-isocyanato-1-methoxy-4-methyl,acmc-20anrw,2-methoxy-5-methylbenzenisocyanate,2-methoxy-5-methylpheny lisocyanate,2-isocyanato-1-methyloxy-4-methylbenzene,benzene, 2-isocyanato-1-methoxy-4-methyl-9ci
IUPAC Name	2-isocyanato-1-methoxy-4-methylbenzene
InChI Key	IDOHLSFNBKNRRJ-UHFFFAOYSA-N
Molecular Formula	C9H9NO2

Aniline and substituted anilines

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