U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C7H8F3N3
Molecular Weight 191.1537
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-(Trifluoromethyl)-1,2,3-benzenetriamine

SMILES

NC1=CC(=CC(N)=C1N)C(F)(F)F

InChI

InChIKey=KXZORAYXGDXVRZ-UHFFFAOYSA-N
InChI=1S/C7H8F3N3/c8-7(9,10)3-1-4(11)6(13)5(12)2-3/h1-2H,11-13H2

HIDE SMILES / InChI

Molecular Formula C7H8F3N3
Molecular Weight 191.1537
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 Sat Dec 16 12:51:08 GMT 2023
Edited
by admin
on Sat Dec 16 12:51:08 GMT 2023
Record UNII
QR6PT9EDY3
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-(Trifluoromethyl)-1,2,3-benzenetriamine
Systematic Name English
NSC-351124
Code English
5-(trifluoromethyl)benzene-1,2,3-triamine
Systematic Name English
Toluene-3,4,5-triamine, α,α,α-trifluoro-
Common Name English
α,α,α-Trifluorotoluene-3,4,5-triamine
Common Name English
1,2,3-Benzenetriamine, 5-(trifluoromethyl)-
Systematic Name English
Code System Code Type Description
CAS
17661-60-8
Created by admin on Sat Dec 16 12:51:08 GMT 2023 , Edited by admin on Sat Dec 16 12:51:08 GMT 2023
PRIMARY
NSC
351124
Created by admin on Sat Dec 16 12:51:08 GMT 2023 , Edited by admin on Sat Dec 16 12:51:08 GMT 2023
PRIMARY
EPA CompTox
DTXSID90170165
Created by admin on Sat Dec 16 12:51:08 GMT 2023 , Edited by admin on Sat Dec 16 12:51:08 GMT 2023
PRIMARY
FDA UNII
QR6PT9EDY3
Created by admin on Sat Dec 16 12:51:08 GMT 2023 , Edited by admin on Sat Dec 16 12:51:08 GMT 2023
PRIMARY
PUBCHEM
100706
Created by admin on Sat Dec 16 12:51:08 GMT 2023 , Edited by admin on Sat Dec 16 12:51:08 GMT 2023
PRIMARY