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Details

Stereochemistry ABSOLUTE
Molecular Formula C9H10F3N
Molecular Weight 189.1776
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-(2,4,5-Trifluorophenyl)propan-2-amine, (S)-

SMILES

C[C@H](N)CC1=C(F)C=C(F)C(F)=C1

InChI

InChIKey=QKVCEEJOYPBGQX-YFKPBYRVSA-N
InChI=1S/C9H10F3N/c1-5(13)2-6-3-8(11)9(12)4-7(6)10/h3-5H,2,13H2,1H3/t5-/m0/s1

HIDE SMILES / InChI

Molecular Formula C9H10F3N
Molecular Weight 189.1776
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 20:12:31 GMT 2025
Edited
by admin
on Wed Apr 02 20:12:31 GMT 2025
Record UNII
ZA3VDU45NA
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-(2,4,5-Trifluorophenyl)propan-2-amine, (S)-
Systematic Name English
(S)-1-(2,4,5-Trifluorophenyl)propan-2-amine
Preferred Name English
2,4,5-Trifluoro-?-methylbenzeneethanamine, (?S)-
Systematic Name English
(?S)-2,4,5-Trifluoro-?-methylbenzeneethanamine
Systematic Name English
Benzeneethanamine, 2,4,5-trifluoro-?-methyl-, (?S)-
Systematic Name English
Code System Code Type Description
CAS
1334816-39-5
Created by admin on Wed Apr 02 20:12:31 GMT 2025 , Edited by admin on Wed Apr 02 20:12:31 GMT 2025
PRIMARY
PUBCHEM
93989984
Created by admin on Wed Apr 02 20:12:31 GMT 2025 , Edited by admin on Wed Apr 02 20:12:31 GMT 2025
PRIMARY
FDA UNII
ZA3VDU45NA
Created by admin on Wed Apr 02 20:12:31 GMT 2025 , Edited by admin on Wed Apr 02 20:12:31 GMT 2025
PRIMARY
Related Record Type Details
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