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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 5-((2-AMINOPHENYL)METHYL)-2-METHYLBENZENE-1,3-DIAMINE

SMILES

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

InChI

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

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 19:34:19 GMT 2025
Edited
by admin
on Tue Apr 01 19:34:19 GMT 2025
Record UNII
UV8WS3V54S
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1,3-BENZENEDIAMINE, 5-((2-AMINOPHENYL)METHYL)-2-METHYL-
Preferred Name English
5-((2-AMINOPHENYL)METHYL)-2-METHYLBENZENE-1,3-DIAMINE
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID30234795
Created by admin on Tue Apr 01 19:34:19 GMT 2025 , Edited by admin on Tue Apr 01 19:34:19 GMT 2025
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CAS
85586-61-4
Created by admin on Tue Apr 01 19:34:19 GMT 2025 , Edited by admin on Tue Apr 01 19:34:19 GMT 2025
PRIMARY
PUBCHEM
3020825
Created by admin on Tue Apr 01 19:34:19 GMT 2025 , Edited by admin on Tue Apr 01 19:34:19 GMT 2025
PRIMARY
ECHA (EC/EINECS)
287-866-5
Created by admin on Tue Apr 01 19:34:19 GMT 2025 , Edited by admin on Tue Apr 01 19:34:19 GMT 2025
PRIMARY
FDA UNII
UV8WS3V54S
Created by admin on Tue Apr 01 19:34:19 GMT 2025 , Edited by admin on Tue Apr 01 19:34:19 GMT 2025
PRIMARY