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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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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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

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Methyl 5-amino-2-methylbenzoate, 97%

CAS: 18595-12-5 Molecular Formula: C9H11NO2 Molecular Weight (g/mol): 165.19 MDL Number: MFCD08752568 InChI Key: JNPZKGOLYSCSEL-UHFFFAOYSA-N PubChem CID: 15049977 IUPAC Name: methyl 5-amino-2-methylbenzoate SMILES: COC(=O)C1=C(C)C=CC(N)=C1

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Specifications

PubChem CID	15049977
CAS	18595-12-5
Molecular Weight (g/mol)	165.19
MDL Number	MFCD08752568
SMILES	COC(=O)C1=C(C)C=CC(N)=C1
IUPAC Name	methyl 5-amino-2-methylbenzoate
InChI Key	JNPZKGOLYSCSEL-UHFFFAOYSA-N
Molecular Formula	C9H11NO2

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2-Methyl-4-(trifluoromethoxy)aniline, 97+%

CAS: 86256-59-9 Molecular Formula: C8H8F3NO Molecular Weight (g/mol): 191.153 MDL Number: MFCD01631541 InChI Key: IIDBMILLZRYZCH-UHFFFAOYSA-N Synonym: 2-methyl-4-trifluoromethoxy aniline,2-methyl-4-trifluoromethoxy benzenamine,4-trifluoromethoxy-2-methylaniline,4-trifluoromethoxy-o-toluidine,benzenamine, 2-methyl-4-trifluoromethoxy,2-methyl-4-trifluoromethoxy phenylamine,pubchem8512,ksc495s8h,2-amino-5-trifluoromethoxy toluene PubChem CID: 2775546 IUPAC Name: 2-methyl-4-(trifluoromethoxy)aniline SMILES: CC1=C(C=CC(=C1)OC(F)(F)F)N

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PubChem CID	2775546
CAS	86256-59-9
Molecular Weight (g/mol)	191.153
MDL Number	MFCD01631541
SMILES	CC1=C(C=CC(=C1)OC(F)(F)F)N
Synonym	2-methyl-4-trifluoromethoxy aniline,2-methyl-4-trifluoromethoxy benzenamine,4-trifluoromethoxy-2-methylaniline,4-trifluoromethoxy-o-toluidine,benzenamine, 2-methyl-4-trifluoromethoxy,2-methyl-4-trifluoromethoxy phenylamine,pubchem8512,ksc495s8h,2-amino-5-trifluoromethoxy toluene
IUPAC Name	2-methyl-4-(trifluoromethoxy)aniline
InChI Key	IIDBMILLZRYZCH-UHFFFAOYSA-N
Molecular Formula	C8H8F3NO

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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

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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

p-Toluidine 99.0+%, TCI America™

CAS: 106-49-0 Molecular Formula: C7H9N Molecular Weight (g/mol): 107.156 MDL Number: MFCD00007906 InChI Key: RZXMPPFPUUCRFN-UHFFFAOYSA-N Synonym: p-toluidine,4-toluidine,p-tolylamine,4-aminotoluene,benzenamine, 4-methyl,4-methylbenzenamine,p-methylaniline,p-methylbenzenamine,p-toluidin,p-aminotoluene PubChem CID: 7813 ChEBI: CHEBI:37825 IUPAC Name: 4-methylaniline SMILES: CC1=CC=C(C=C1)N

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PubChem CID	7813
CAS	106-49-0
Molecular Weight (g/mol)	107.156
ChEBI	CHEBI:37825
MDL Number	MFCD00007906
SMILES	CC1=CC=C(C=C1)N
Synonym	p-toluidine,4-toluidine,p-tolylamine,4-aminotoluene,benzenamine, 4-methyl,4-methylbenzenamine,p-methylaniline,p-methylbenzenamine,p-toluidin,p-aminotoluene
IUPAC Name	4-methylaniline
InChI Key	RZXMPPFPUUCRFN-UHFFFAOYSA-N
Molecular Formula	C7H9N

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p-Toluidine, 99%, crystalline molten mass

CAS: 106-49-0 Molecular Formula: C₇H₉N Molecular Weight (g/mol): 107.16 InChI Key: RZXMPPFPUUCRFN-UHFFFAOYSA-N Synonym: p-toluidine,4-toluidine,p-tolylamine,4-aminotoluene,benzenamine, 4-methyl,4-methylbenzenamine,p-methylaniline,p-methylbenzenamine,p-toluidin,p-aminotoluene PubChem CID: 7813 ChEBI: CHEBI:37825 IUPAC Name: 4-methylaniline SMILES: CC1=CC=C(C=C1)N

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Specifications

PubChem CID	7813
CAS	106-49-0
Molecular Weight (g/mol)	107.16
ChEBI	CHEBI:37825
SMILES	CC1=CC=C(C=C1)N
Synonym	p-toluidine,4-toluidine,p-tolylamine,4-aminotoluene,benzenamine, 4-methyl,4-methylbenzenamine,p-methylaniline,p-methylbenzenamine,p-toluidin,p-aminotoluene
IUPAC Name	4-methylaniline
InChI Key	RZXMPPFPUUCRFN-UHFFFAOYSA-N
Molecular Formula	C₇H₉N

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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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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

3-(N-Ethyl-3-methylanilino)-2-hydroxypropanesulfonic acid sodium salt,Spectrophotometric Det. of H2O2, ≥98.0%, MilliporeSigma™ Supelco™

MDL Number: MFCD00040641 Synonym: 3-(N-Ethyl-m-toluidino)-2-hydroxypropanesulfonic acid sodium salt; N-Ethyl-N-(2-hydroxy-3-sulfopropyl)-m-toluidine sodium salt; Sodium 3-(N-ethyl-3-methylanilino)-2-hydroxypropanesulfonate; Sodium N-ethyl-N-(2-hydroxy-3-sulfopropyl)-m-toluidine; TOOS

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Specifications

MDL Number	MFCD00040641
Synonym	3-(N-Ethyl-m-toluidino)-2-hydroxypropanesulfonic acid sodium salt; N-Ethyl-N-(2-hydroxy-3-sulfopropyl)-m-toluidine sodium salt; Sodium 3-(N-ethyl-3-methylanilino)-2-hydroxypropanesulfonate; Sodium N-ethyl-N-(2-hydroxy-3-sulfopropyl)-m-toluidine; TOOS

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3-Amino-4-methylbiphenyl, 98%

CAS: 80938-67-6 Molecular Formula: C13H13N Molecular Weight (g/mol): 183.25 MDL Number: MFCD00270126 InChI Key: YLKSTPDTTKOSIL-UHFFFAOYSA-N Synonym: 5-phenyl-o-toluidine,3-amino-4-methylbiphenyl,4-methyl-1,1'-biphenyl-3-amine,2-methyl-5-phenylphenylamine,1,1'-biphenyl-3-amine, 4-methyl,4-methylbiphenyl-3-amine,2-methyl-5-phenyl-aniline PubChem CID: 149880 IUPAC Name: 2-methyl-5-phenylaniline SMILES: CC1=CC=C(C=C1N)C1=CC=CC=C1

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Specifications

PubChem CID	149880
CAS	80938-67-6
Molecular Weight (g/mol)	183.25
MDL Number	MFCD00270126
SMILES	CC1=CC=C(C=C1N)C1=CC=CC=C1
Synonym	5-phenyl-o-toluidine,3-amino-4-methylbiphenyl,4-methyl-1,1'-biphenyl-3-amine,2-methyl-5-phenylphenylamine,1,1'-biphenyl-3-amine, 4-methyl,4-methylbiphenyl-3-amine,2-methyl-5-phenyl-aniline
IUPAC Name	2-methyl-5-phenylaniline
InChI Key	YLKSTPDTTKOSIL-UHFFFAOYSA-N
Molecular Formula	C13H13N

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

CAS: 627871-16-3 Molecular Formula: C7H7BrFN Molecular Weight (g/mol): 204.04 MDL Number: MFCD05865218 InChI Key: DNCLVDGUXUSPTL-UHFFFAOYSA-N Synonym: 2-amino-4-bromo-5-fluorotoluene,5-bromo-4-fluoro-2-methylbenzenamine,benzenamine, 5-bromo-4-fluoro-2-methyl,5-bromo-4-fluoro-o-toluidine,5-bromo-4-fluoro-2-methyl-phenylamine,2-amino-4-bromo-5-fluoro-toluene,2-amino-4-bromo-5-fluorotoluene 5-bromo-4-fluoro-2-methylaniline,5-bromo-4-fluoro-2-methyl-aniline,acmc-20agns,pubchem2934 PubChem CID: 2782786 IUPAC Name: 5-bromo-4-fluoro-2-methylaniline SMILES: CC1=CC(F)=C(Br)C=C1N

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Specifications

PubChem CID	2782786
CAS	627871-16-3
Molecular Weight (g/mol)	204.04
MDL Number	MFCD05865218
SMILES	CC1=CC(F)=C(Br)C=C1N
Synonym	2-amino-4-bromo-5-fluorotoluene,5-bromo-4-fluoro-2-methylbenzenamine,benzenamine, 5-bromo-4-fluoro-2-methyl,5-bromo-4-fluoro-o-toluidine,5-bromo-4-fluoro-2-methyl-phenylamine,2-amino-4-bromo-5-fluoro-toluene,2-amino-4-bromo-5-fluorotoluene 5-bromo-4-fluoro-2-methylaniline,5-bromo-4-fluoro-2-methyl-aniline,acmc-20agns,pubchem2934
IUPAC Name	5-bromo-4-fluoro-2-methylaniline
InChI Key	DNCLVDGUXUSPTL-UHFFFAOYSA-N
Molecular Formula	C7H7BrFN

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3-Fluoro-2-methylaniline, 98+%

CAS: 443-86-7 Molecular Formula: C7H8FN Molecular Weight (g/mol): 125.15 MDL Number: MFCD00007760 InChI Key: SLDLVGFPFFLYBM-UHFFFAOYSA-N Synonym: 3-fluoro-o-toluidine,2-fluoro-6-aminotoluene,2-amino-6-fluorotoluene,6-amino-2-fluorotoluene,3-fluoro-2-methyl-aniline,benzenamine, 3-fluoro-2-methyl,3-fluoro-2-methylphenylamine,2-methyl-3-fluoroaniline,hydrochloride,3-fluor-2-methylanilin PubChem CID: 285553 IUPAC Name: 3-fluoro-2-methylaniline SMILES: CC1=C(N)C=CC=C1F

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Specifications

PubChem CID	285553
CAS	443-86-7
Molecular Weight (g/mol)	125.15
MDL Number	MFCD00007760
SMILES	CC1=C(N)C=CC=C1F
Synonym	3-fluoro-o-toluidine,2-fluoro-6-aminotoluene,2-amino-6-fluorotoluene,6-amino-2-fluorotoluene,3-fluoro-2-methyl-aniline,benzenamine, 3-fluoro-2-methyl,3-fluoro-2-methylphenylamine,2-methyl-3-fluoroaniline,hydrochloride,3-fluor-2-methylanilin
IUPAC Name	3-fluoro-2-methylaniline
InChI Key	SLDLVGFPFFLYBM-UHFFFAOYSA-N
Molecular Formula	C7H8FN

3-Amino-4-methylphenylboronic acid, 98%, Thermo Scientific™

CAS: 22237-12-3 Molecular Formula: C7H11BClNO2 Molecular Weight (g/mol): 187.43 MDL Number: MFCD01632201 InChI Key: BKFDOPYYSBQWIK-UHFFFAOYSA-N Synonym: 3-amino-4-methylphenyl boronic acid,3-amino-4-methylbenzeneboronic acid,3-amino-4-methyl-phenyl boronic acid,3-amino-p-tolylboronic acid,boronic acid, 3-amino-4-methylphenyl,acmc-20agxu,pubchem1745,3-amino-4-methylphenylboranic acid,3-amino4methyl phenyl boronic acid PubChem CID: 2737803 SMILES: Cl.CC1=CC=C(C=C1N)B(O)O

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Specifications

PubChem CID	2737803
CAS	22237-12-3
Molecular Weight (g/mol)	187.43
MDL Number	MFCD01632201
SMILES	Cl.CC1=CC=C(C=C1N)B(O)O
Synonym	3-amino-4-methylphenyl boronic acid,3-amino-4-methylbenzeneboronic acid,3-amino-4-methyl-phenyl boronic acid,3-amino-p-tolylboronic acid,boronic acid, 3-amino-4-methylphenyl,acmc-20agxu,pubchem1745,3-amino-4-methylphenylboranic acid,3-amino4methyl phenyl boronic acid
InChI Key	BKFDOPYYSBQWIK-UHFFFAOYSA-N
Molecular Formula	C7H11BClNO2

4-Methyldiphenylamine, 98%

CAS: 620-84-8 Molecular Formula: C13H13N Molecular Weight (g/mol): 183.25 MDL Number: MFCD00092921 InChI Key: AGHYMXKKEXDUTA-UHFFFAOYSA-N Synonym: 4-methyldiphenylamine,benzenamine, 4-methyl-n-phenyl,n-phenyl-p-toluidine,4-methyl-n-phenyl-aniline,4-methyl-n-phenylbenzamine,4-methylphenyl phenylamine,phenyl-p-tolylamine,4-methyldiphenylamin,phenyl-p-tolyl-amine,n-pnenyl-4-methylaniline PubChem CID: 12109 IUPAC Name: 4-methyl-N-phenylaniline SMILES: CC1=CC=C(NC2=CC=CC=C2)C=C1

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PubChem CID	12109
CAS	620-84-8
Molecular Weight (g/mol)	183.25
MDL Number	MFCD00092921
SMILES	CC1=CC=C(NC2=CC=CC=C2)C=C1
Synonym	4-methyldiphenylamine,benzenamine, 4-methyl-n-phenyl,n-phenyl-p-toluidine,4-methyl-n-phenyl-aniline,4-methyl-n-phenylbenzamine,4-methylphenyl phenylamine,phenyl-p-tolylamine,4-methyldiphenylamin,phenyl-p-tolyl-amine,n-pnenyl-4-methylaniline
IUPAC Name	4-methyl-N-phenylaniline
InChI Key	AGHYMXKKEXDUTA-UHFFFAOYSA-N
Molecular Formula	C13H13N

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2-Fluoro-5-methylaniline, 98%

CAS: 452-84-6 Molecular Formula: C7H8FN Molecular Weight (g/mol): 125.15 MDL Number: MFCD00007654 InChI Key: QZUXMXZNVAJNSE-UHFFFAOYSA-N Synonym: 3-amino-4-fluorotoluene,6-fluoro-m-toluidine,2-fluoro-5-methylphenylamine,2-fluoro-5-methylbenzenamine,benzenamine, 2-fluoro-5-methyl,2-fluoro-5-methylbenzeneamine,2-fluoro-5-methyl-aniline,pubchem1507,2-fluoro-5-metylaniline,acmc-209k1v PubChem CID: 262970 IUPAC Name: 2-fluoro-5-methylaniline SMILES: CC1=CC=C(F)C(N)=C1

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Specifications

PubChem CID	262970
CAS	452-84-6
Molecular Weight (g/mol)	125.15
MDL Number	MFCD00007654
SMILES	CC1=CC=C(F)C(N)=C1
Synonym	3-amino-4-fluorotoluene,6-fluoro-m-toluidine,2-fluoro-5-methylphenylamine,2-fluoro-5-methylbenzenamine,benzenamine, 2-fluoro-5-methyl,2-fluoro-5-methylbenzeneamine,2-fluoro-5-methyl-aniline,pubchem1507,2-fluoro-5-metylaniline,acmc-209k1v
IUPAC Name	2-fluoro-5-methylaniline
InChI Key	QZUXMXZNVAJNSE-UHFFFAOYSA-N
Molecular Formula	C7H8FN

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