2-[(3-Amino-4-methylphenyl)methyl]-1,3-benzenediamine

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Details

Stereochemistry	ACHIRAL
Molecular Formula	C14H17N3
Molecular Weight	227.3049
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2-[(3-Amino-4-methylphenyl)methyl]-1,3-benzenediamine

Structure Search

SMILES

CC1=CC=C(CC2=C(N)C=CC=C2N)C=C1N

InChI

InChIKey=KSCQGJYKWUJKCO-UHFFFAOYSA-N

InChI=1S/C14H17N3/c1-9-5-6-10(8-14(9)17)7-11-12(15)3-2-4-13(11)16/h2-6,8H,7,15-17H2,1H3

HIDE SMILES / InChI

Molecular Formula	C14H17N3
Molecular Weight	227.3049
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

Substance Class	Chemical Created by `admin` on `Tue Apr 01 19:14:38 GMT 2025` Edited by `admin` on `Tue Apr 01 19:14:38 GMT 2025`
Record UNII	LM9ZWX4CSG
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2-[(3-Amino-4-methylphenyl)methyl]-1,3-benzenediamine

Systematic Name

English

2-[(3-Amino-4-methylphenyl)methyl]benzene-1,3-diamine

Preferred Name

English

1,3-Benzenediamine, 2-[(3-amino-4-methylphenyl)methyl]-

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID40241051

Created by admin on Tue Apr 01 19:14:38 GMT 2025 , Edited by admin on Tue Apr 01 19:14:38 GMT 2025

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ECHA (EC/EINECS)

303-734-2

Created by admin on Tue Apr 01 19:14:38 GMT 2025 , Edited by admin on Tue Apr 01 19:14:38 GMT 2025

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CAS

94213-31-7

Created by admin on Tue Apr 01 19:14:38 GMT 2025 , Edited by admin on Tue Apr 01 19:14:38 GMT 2025

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PUBCHEM

3024038

Created by admin on Tue Apr 01 19:14:38 GMT 2025 , Edited by admin on Tue Apr 01 19:14:38 GMT 2025

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FDA UNII

LM9ZWX4CSG

Created by admin on Tue Apr 01 19:14:38 GMT 2025 , Edited by admin on Tue Apr 01 19:14:38 GMT 2025

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