Aminotoluenes

Organic compounds that consist of an aryl amine substituted with a methyl group; their chemical structures are similar to aniline. These compounds are also known as toluidines.

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m-Toluidine, 99%

CAS: 108-44-1 Molecular Formula: C7H9N Molecular Weight (g/mol): 107.16 MDL Number: MFCD00007808 InChI Key: JJYPMNFTHPTTDI-UHFFFAOYSA-N Synonym: m-toluidine,3-toluidine,benzenamine, 3-methyl,3-aminotoluene,m-methylaniline,m-tolylamine,m-toluidin,m-aminotoluene,m-methylbenzenamine,3-methylbenzenamine PubChem CID: 7934 IUPAC Name: 3-methylaniline SMILES: CC1=CC=CC(N)=C1

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PubChem CID	7934
CAS	108-44-1
Molecular Weight (g/mol)	107.16
MDL Number	MFCD00007808
SMILES	CC1=CC=CC(N)=C1
Synonym	m-toluidine,3-toluidine,benzenamine, 3-methyl,3-aminotoluene,m-methylaniline,m-tolylamine,m-toluidin,m-aminotoluene,m-methylbenzenamine,3-methylbenzenamine
IUPAC Name	3-methylaniline
InChI Key	JJYPMNFTHPTTDI-UHFFFAOYSA-N
Molecular Formula	C7H9N

o-Tolidine dihydrochloride, ACS

CAS: 612-82-8 Molecular Formula: C14H18Cl2N2 Molecular Weight (g/mol): 285.212 MDL Number: MFCD00012960 InChI Key: LUKPNZHXJRJBAN-UHFFFAOYSA-N Synonym: 3,3'-dimethylbenzidine dihydrochloride,o-tolidine dihydrochloride,3,3'-dimethyl-1,1'-biphenyl-4,4'-diamine dihydrochloride,unii-5msk350kd8,dsstox_cid_511,dsstox_rid_75633,dsstox_gsid_20511,tolidine dihydrochloride,1,1'-biphenyl-4,4'-diamine, 3,3'-dimethyl-, dihydrochloride,3,3'-dimethylbenzidine.2hcl PubChem CID: 108938 IUPAC Name: 4-(4-amino-3-methylphenyl)-2-methylaniline;dihydrochloride SMILES: CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N)C)N.Cl.Cl

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Specifications

PubChem CID	108938
CAS	612-82-8
Molecular Weight (g/mol)	285.212
MDL Number	MFCD00012960
SMILES	CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N)C)N.Cl.Cl
Synonym	3,3'-dimethylbenzidine dihydrochloride,o-tolidine dihydrochloride,3,3'-dimethyl-1,1'-biphenyl-4,4'-diamine dihydrochloride,unii-5msk350kd8,dsstox_cid_511,dsstox_rid_75633,dsstox_gsid_20511,tolidine dihydrochloride,1,1'-biphenyl-4,4'-diamine, 3,3'-dimethyl-, dihydrochloride,3,3'-dimethylbenzidine.2hcl
IUPAC Name	4-(4-amino-3-methylphenyl)-2-methylaniline;dihydrochloride
InChI Key	LUKPNZHXJRJBAN-UHFFFAOYSA-N
Molecular Formula	C14H18Cl2N2

o-Tolidine, 98%

CAS: 119-93-7 Molecular Formula: C14H16N2 Molecular Weight (g/mol): 212.296 MDL Number: MFCD00014773 InChI Key: NUIURNJTPRWVAP-UHFFFAOYSA-N Synonym: o-tolidine,3,3'-dimethylbenzidine,orthotolidine,diaminoditolyl,2-tolidine,diaminotolyl,bianisidine,3,3'-tolidine,3,3'-dimethylbiphenyl-4,4'-diamine,4,4'-bi-o-toluidine PubChem CID: 8413 ChEBI: CHEBI:34320 IUPAC Name: 4-(4-amino-3-methylphenyl)-2-methylaniline SMILES: CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N)C)N

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Specifications

PubChem CID	8413
CAS	119-93-7
Molecular Weight (g/mol)	212.296
ChEBI	CHEBI:34320
MDL Number	MFCD00014773
SMILES	CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N)C)N
Synonym	o-tolidine,3,3'-dimethylbenzidine,orthotolidine,diaminoditolyl,2-tolidine,diaminotolyl,bianisidine,3,3'-tolidine,3,3'-dimethylbiphenyl-4,4'-diamine,4,4'-bi-o-toluidine
IUPAC Name	4-(4-amino-3-methylphenyl)-2-methylaniline
InChI Key	NUIURNJTPRWVAP-UHFFFAOYSA-N
Molecular Formula	C14H16N2

N,N-Dimethyl-p-toluidine, 99%

CAS: 99-97-8 Molecular Formula: C9H13N Molecular Weight (g/mol): 135.21 MDL Number: MFCD00008316 InChI Key: GYVGXEWAOAAJEU-UHFFFAOYSA-N Synonym: n,n-dimethyl-p-toluidine,dimethyl-p-toluidine,benzenamine, n,n,4-trimethyl,n,n-dimethyl-4-methylaniline,n,n-dimethyl-para-toluidine,4,n,n-trimethylaniline,dimethyl-4-toluidine,p-dimethylamino toluene,n,n-dimethyl-p-tolylamine,n,n,4-trimethylbenzenamine PubChem CID: 7471 IUPAC Name: N,N,4-trimethylaniline SMILES: CN(C)C1=CC=C(C)C=C1

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Specifications

PubChem CID	7471
CAS	99-97-8
Molecular Weight (g/mol)	135.21
MDL Number	MFCD00008316
SMILES	CN(C)C1=CC=C(C)C=C1
Synonym	n,n-dimethyl-p-toluidine,dimethyl-p-toluidine,benzenamine, n,n,4-trimethyl,n,n-dimethyl-4-methylaniline,n,n-dimethyl-para-toluidine,4,n,n-trimethylaniline,dimethyl-4-toluidine,p-dimethylamino toluene,n,n-dimethyl-p-tolylamine,n,n,4-trimethylbenzenamine
IUPAC Name	N,N,4-trimethylaniline
InChI Key	GYVGXEWAOAAJEU-UHFFFAOYSA-N
Molecular Formula	C9H13N

o-Toluidine, 99%

CAS: 95-53-4 Molecular Formula: C₇H₉N Molecular Weight (g/mol): 107.15 MDL Number: MFCD00007730 InChI Key: RNVCVTLRINQCPJ-UHFFFAOYSA-N Synonym: o-toluidine,2-toluidine,o-tolylamine,2-aminotoluene,2-methylbenzenamine,ortho-toluidine,o-methylaniline,benzenamine, 2-methyl,o-aminotoluene,o-methylbenzenamine PubChem CID: 7242 ChEBI: CHEBI:66892 IUPAC Name: 2-methylaniline SMILES: CC1=CC=CC=C1N

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Specifications

PubChem CID	7242
CAS	95-53-4
Molecular Weight (g/mol)	107.15
ChEBI	CHEBI:66892
MDL Number	MFCD00007730
SMILES	CC1=CC=CC=C1N
Synonym	o-toluidine,2-toluidine,o-tolylamine,2-aminotoluene,2-methylbenzenamine,ortho-toluidine,o-methylaniline,benzenamine, 2-methyl,o-aminotoluene,o-methylbenzenamine
IUPAC Name	2-methylaniline
InChI Key	RNVCVTLRINQCPJ-UHFFFAOYSA-N
Molecular Formula	C₇H₉N

o-Tolidine, 95%, pract

CAS: 119-93-7 MDL Number: MFCD00014773 InChI Key: NUIURNJTPRWVAP-UHFFFAOYSA-N Synonym: o-tolidine,3,3'-dimethylbenzidine,orthotolidine,diaminoditolyl,2-tolidine,diaminotolyl,bianisidine,3,3'-tolidine,3,3'-dimethylbiphenyl-4,4'-diamine,4,4'-bi-o-toluidine PubChem CID: 8413 ChEBI: CHEBI:34320 IUPAC Name: 4-(4-amino-3-methylphenyl)-2-methylaniline SMILES: CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N)C)N

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Specifications

PubChem CID	8413
CAS	119-93-7
ChEBI	CHEBI:34320
MDL Number	MFCD00014773
SMILES	CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N)C)N
Synonym	o-tolidine,3,3'-dimethylbenzidine,orthotolidine,diaminoditolyl,2-tolidine,diaminotolyl,bianisidine,3,3'-tolidine,3,3'-dimethylbiphenyl-4,4'-diamine,4,4'-bi-o-toluidine
IUPAC Name	4-(4-amino-3-methylphenyl)-2-methylaniline
InChI Key	NUIURNJTPRWVAP-UHFFFAOYSA-N

3-Bromo-4-methylaniline, 97%

CAS: 7745-91-7 Molecular Formula: C7H8BrN Molecular Weight (g/mol): 186.05 MDL Number: MFCD00134176 InChI Key: GRXMMIBZRMKADT-UHFFFAOYSA-N Synonym: 3-bromo-p-toluidine,p-toluidine, 3-bromo,benzenamine, 3-bromo-4-methyl,3-bromo-4-methyl-phenylamine,3-bromo-1,4-toluidine,4-amino-2-bromotoluene,3-bromo-4-methylbenzenamine,3-bromo-4-methylphenylamine,3-bromo-para-toluidine,3-bromo-4-methyl-aniline PubChem CID: 82187 IUPAC Name: 3-bromo-4-methylaniline SMILES: CC1=CC=C(N)C=C1Br

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Specifications

PubChem CID	82187
CAS	7745-91-7
Molecular Weight (g/mol)	186.05
MDL Number	MFCD00134176
SMILES	CC1=CC=C(N)C=C1Br
Synonym	3-bromo-p-toluidine,p-toluidine, 3-bromo,benzenamine, 3-bromo-4-methyl,3-bromo-4-methyl-phenylamine,3-bromo-1,4-toluidine,4-amino-2-bromotoluene,3-bromo-4-methylbenzenamine,3-bromo-4-methylphenylamine,3-bromo-para-toluidine,3-bromo-4-methyl-aniline
IUPAC Name	3-bromo-4-methylaniline
InChI Key	GRXMMIBZRMKADT-UHFFFAOYSA-N
Molecular Formula	C7H8BrN

PubChem CID	108938
CAS	612-82-8
Molecular Weight (g/mol)	285.212
MDL Number	MFCD00012960
SMILES	CC1=C(C=CC(=C1)C2=CC(=C(C=C2)N)C)N.Cl.Cl
Synonym	3,3'-dimethylbenzidine dihydrochloride,o-tolidine dihydrochloride,3,3'-dimethyl-1,1'-biphenyl-4,4'-diamine dihydrochloride,unii-5msk350kd8,dsstox_cid_511,dsstox_rid_75633,dsstox_gsid_20511,tolidine dihydrochloride,1,1'-biphenyl-4,4'-diamine, 3,3'-dimethyl-, dihydrochloride,3,3'-dimethylbenzidine.2hcl
IUPAC Name	4-(4-amino-3-methylphenyl)-2-methylaniline;dihydrochloride
InChI Key	LUKPNZHXJRJBAN-UHFFFAOYSA-N
Molecular Formula	C14H18Cl2N2

2-Chloro-6-methylaniline, 98%

CAS: 87-63-8 Molecular Formula: C7H8ClN Molecular Weight (g/mol): 141.60 MDL Number: MFCD00007679 InChI Key: WFNLHDJJZSJARK-UHFFFAOYSA-N Synonym: 6-chloro-2-methylaniline,6-chloro-o-toluidine,2-amino-3-chlorotoluene,benzenamine, 2-chloro-6-methyl,3-chloro-2-aminotoluene,6-chloro-2-toluidine,2-methyl-6-chloroaniline,o-toluidine, 6-chloro,2-chloro-6-methyl-aniline,2-chloro-6-methylaninile PubChem CID: 6897 IUPAC Name: 2-chloro-6-methylaniline SMILES: CC1=CC=CC(Cl)=C1N

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Specifications

PubChem CID	6897
CAS	87-63-8
Molecular Weight (g/mol)	141.60
MDL Number	MFCD00007679
SMILES	CC1=CC=CC(Cl)=C1N
Synonym	6-chloro-2-methylaniline,6-chloro-o-toluidine,2-amino-3-chlorotoluene,benzenamine, 2-chloro-6-methyl,3-chloro-2-aminotoluene,6-chloro-2-toluidine,2-methyl-6-chloroaniline,o-toluidine, 6-chloro,2-chloro-6-methyl-aniline,2-chloro-6-methylaninile
IUPAC Name	2-chloro-6-methylaniline
InChI Key	WFNLHDJJZSJARK-UHFFFAOYSA-N
Molecular Formula	C7H8ClN

2-Fluoro-4-methylaniline, 99%

CAS: 452-80-2 Molecular Formula: C7H8FN Molecular Weight (g/mol): 125.15 MDL Number: MFCD00040975 InChI Key: ZQEXBVHABAJPHJ-UHFFFAOYSA-N Synonym: 2-fluoro-4-methyaniline,2-fluoro-p-toluidine,4-amino-3-fluorotoluene,p-toluidine, 2-fluoro,benzenamine, 2-fluoro-4-methyl,2-fluoro-4-methyl aniline,2-fluoro-4-methyl-aniline,2-fluoro-4-methyl-phenylamine,2-fluoro-4-methylphenylamine,benzenamine, 2-fluoro-4-methyl-9ci PubChem CID: 67984 IUPAC Name: 2-fluoro-4-methylaniline SMILES: CC1=CC=C(N)C(F)=C1

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Specifications

PubChem CID	67984
CAS	452-80-2
Molecular Weight (g/mol)	125.15
MDL Number	MFCD00040975
SMILES	CC1=CC=C(N)C(F)=C1
Synonym	2-fluoro-4-methyaniline,2-fluoro-p-toluidine,4-amino-3-fluorotoluene,p-toluidine, 2-fluoro,benzenamine, 2-fluoro-4-methyl,2-fluoro-4-methyl aniline,2-fluoro-4-methyl-aniline,2-fluoro-4-methyl-phenylamine,2-fluoro-4-methylphenylamine,benzenamine, 2-fluoro-4-methyl-9ci
IUPAC Name	2-fluoro-4-methylaniline
InChI Key	ZQEXBVHABAJPHJ-UHFFFAOYSA-N
Molecular Formula	C7H8FN

Methyl 2-amino-3-methylbenzoate, 98%

CAS: 22223-49-0 Molecular Formula: C9H11NO2 Molecular Weight (g/mol): 165.192 MDL Number: MFCD06200918 InChI Key: VSFYTPXXMLJNAU-UHFFFAOYSA-N Synonym: methyl 3-methylanthranilate,2-amino-3-methylbenzoic acid methyl ester,benzoic acid, 2-amino-3-methyl-, methyl ester,methyl 2-amino-3-methylbenzenecarboxylate,2-amino-3-methyl-benzoic acid methyl ester,methyl2-amino-3-methylbenzoate,pubchem10929,acmc-209ftn,methyl 2-amino-m-toluate,ksc495o6t PubChem CID: 2763406 IUPAC Name: methyl 2-amino-3-methylbenzoate SMILES: CC1=CC=CC(=C1N)C(=O)OC

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Specifications

PubChem CID	2763406
CAS	22223-49-0
Molecular Weight (g/mol)	165.192
MDL Number	MFCD06200918
SMILES	CC1=CC=CC(=C1N)C(=O)OC
Synonym	methyl 3-methylanthranilate,2-amino-3-methylbenzoic acid methyl ester,benzoic acid, 2-amino-3-methyl-, methyl ester,methyl 2-amino-3-methylbenzenecarboxylate,2-amino-3-methyl-benzoic acid methyl ester,methyl2-amino-3-methylbenzoate,pubchem10929,acmc-209ftn,methyl 2-amino-m-toluate,ksc495o6t
IUPAC Name	methyl 2-amino-3-methylbenzoate
InChI Key	VSFYTPXXMLJNAU-UHFFFAOYSA-N
Molecular Formula	C9H11NO2

4-Amino-3-methylbenzonitrile, 98%

CAS: 78881-21-7 Molecular Formula: C8H8N2 Molecular Weight (g/mol): 132.166 MDL Number: MFCD02093969 InChI Key: MBZDCUMFFPWLTJ-UHFFFAOYSA-N Synonym: 3-methyl-4-aminobenzonitrile,4-cyano-o-toluidine,2-amino-5-cyanotoluene,4-cyano-2-methylaniline,4-amino-3-methyl-benzonitrile,benzonitrile, 4-amino-3-methyl,pubchem4667,4-cyano-2-methyianiline,2-methyl-4-cyanoaniline,acmc-1bc2f PubChem CID: 7010316 IUPAC Name: 4-amino-3-methylbenzonitrile SMILES: CC1=C(C=CC(=C1)C#N)N

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Specifications

PubChem CID	7010316
CAS	78881-21-7
Molecular Weight (g/mol)	132.166
MDL Number	MFCD02093969
SMILES	CC1=C(C=CC(=C1)C#N)N
Synonym	3-methyl-4-aminobenzonitrile,4-cyano-o-toluidine,2-amino-5-cyanotoluene,4-cyano-2-methylaniline,4-amino-3-methyl-benzonitrile,benzonitrile, 4-amino-3-methyl,pubchem4667,4-cyano-2-methyianiline,2-methyl-4-cyanoaniline,acmc-1bc2f
IUPAC Name	4-amino-3-methylbenzonitrile
InChI Key	MBZDCUMFFPWLTJ-UHFFFAOYSA-N
Molecular Formula	C8H8N2

1-(2-Methylphenyl)piperazine, 98%

CAS: 39512-51-1 Molecular Formula: C₁₁H₁₆N₂ Molecular Weight (g/mol): 176.26 MDL Number: MFCD00040729 InChI Key: WICKLEOONJPMEQ-UHFFFAOYSA-N Synonym: 1-2-methylphenyl piperazine,1-o-tolyl piperazine,4-2-methylphenyl piperazine,1-o-tolylpiperazine,piperazine, 1-2-methylphenyl,1-o-tolyl-piperazine,1-2-methylphenyl-piperazine,o-tolylpiperazine,2-methylphenylpiperazine,chembl9746 PubChem CID: 91965 IUPAC Name: 1-(2-methylphenyl)piperazine SMILES: CC1=CC=CC=C1N2CCNCC2

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Specifications

PubChem CID	91965
CAS	39512-51-1
Molecular Weight (g/mol)	176.26
MDL Number	MFCD00040729
SMILES	CC1=CC=CC=C1N2CCNCC2
Synonym	1-2-methylphenyl piperazine,1-o-tolyl piperazine,4-2-methylphenyl piperazine,1-o-tolylpiperazine,piperazine, 1-2-methylphenyl,1-o-tolyl-piperazine,1-2-methylphenyl-piperazine,o-tolylpiperazine,2-methylphenylpiperazine,chembl9746
IUPAC Name	1-(2-methylphenyl)piperazine
InChI Key	WICKLEOONJPMEQ-UHFFFAOYSA-N
Molecular Formula	C₁₁H₁₆N₂

3-Chloro-4-methylaniline, 98%

CAS: 95-74-9 Molecular Formula: C7H8ClN Molecular Weight (g/mol): 141.598 MDL Number: MFCD00007773 InChI Key: RQKFYFNZSHWXAW-UHFFFAOYSA-N Synonym: 3-chloro-p-toluidine,2-chloro-4-aminotoluene,4-amino-2-chlorotoluene,benzenamine, 3-chloro-4-methyl,3-chloro-4-methylbenzenamine,3-chloro-4-methylphenylamine,1-amino-3-chloro-4-methylbenzene,4-methyl-3-chloroaniline,p-toluidine, 3-chloro,gull toxicant PubChem CID: 7255 ChEBI: CHEBI:37824 IUPAC Name: 3-chloro-4-methylaniline SMILES: CC1=C(C=C(C=C1)N)Cl

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Specifications

PubChem CID	7255
CAS	95-74-9
Molecular Weight (g/mol)	141.598
ChEBI	CHEBI:37824
MDL Number	MFCD00007773
SMILES	CC1=C(C=C(C=C1)N)Cl
Synonym	3-chloro-p-toluidine,2-chloro-4-aminotoluene,4-amino-2-chlorotoluene,benzenamine, 3-chloro-4-methyl,3-chloro-4-methylbenzenamine,3-chloro-4-methylphenylamine,1-amino-3-chloro-4-methylbenzene,4-methyl-3-chloroaniline,p-toluidine, 3-chloro,gull toxicant
IUPAC Name	3-chloro-4-methylaniline
InChI Key	RQKFYFNZSHWXAW-UHFFFAOYSA-N
Molecular Formula	C7H8ClN

2-Chloro-5-methylaniline, 98%

CAS: 95-81-8 Molecular Formula: C7H8ClN Molecular Weight (g/mol): 141.60 MDL Number: MFCD00007674 InChI Key: HPSCXFOQUFPEPE-UHFFFAOYSA-N Synonym: benzenamine, 2-chloro-5-methyl,6-chloro-m-toluidine,3-amino-4-chlorotoluene,2-chlor-5-methyl-aniline,2-chloro-5-methylbenzenamine,2-chloro-5-methylphenylamine,ccris 2888,2-chloro-5-methyl aniline,6-chlor-meta-toluidin,pubchem18921 PubChem CID: 66770 IUPAC Name: 2-chloro-5-methylaniline SMILES: CC1=CC=C(Cl)C(N)=C1

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Specifications

PubChem CID	66770
CAS	95-81-8
Molecular Weight (g/mol)	141.60
MDL Number	MFCD00007674
SMILES	CC1=CC=C(Cl)C(N)=C1
Synonym	benzenamine, 2-chloro-5-methyl,6-chloro-m-toluidine,3-amino-4-chlorotoluene,2-chlor-5-methyl-aniline,2-chloro-5-methylbenzenamine,2-chloro-5-methylphenylamine,ccris 2888,2-chloro-5-methyl aniline,6-chlor-meta-toluidin,pubchem18921
IUPAC Name	2-chloro-5-methylaniline
InChI Key	HPSCXFOQUFPEPE-UHFFFAOYSA-N
Molecular Formula	C7H8ClN

Aminotoluenes

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