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Details

Stereochemistry ABSOLUTE
Molecular Formula C3H6F3N.ClH
Molecular Weight 149.543
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,1,1-Trifluoropropan-2-amine hydrochloride, (S)-

SMILES

Cl.C[C@H](N)C(F)(F)F

InChI

InChIKey=VLVCERQEOKPRTG-DKWTVANSSA-N
InChI=1S/C3H6F3N.ClH/c1-2(7)3(4,5)6;/h2H,7H2,1H3;1H/t2-;/m0./s1

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C3H6F3N
Molecular Weight 113.0816
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 21:04:20 GMT 2025
Edited
by admin
on Wed Apr 02 21:04:20 GMT 2025
Record UNII
ZL2SFN3ZHZ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1,1,1-Trifluoropropan-2-amine hydrochloride, (S)-
Systematic Name English
(1S)-2,2,2-Trifluoro-1-methylethylamine hydrochloride
Preferred Name English
2-Propanamine, 1,1,1-trifluoro-, hydrochloride (1:1), (2S)-
Systematic Name English
(2S)-1,1,1-Trifluoropropan-2-amine hydrochloride
Systematic Name English
(S)-1,1,1-Trifluoropropan-2-amine hydrochloride
Systematic Name English
Code System Code Type Description
FDA UNII
ZL2SFN3ZHZ
Created by admin on Wed Apr 02 21:04:20 GMT 2025 , Edited by admin on Wed Apr 02 21:04:20 GMT 2025
PRIMARY
CAS
125353-44-8
Created by admin on Wed Apr 02 21:04:20 GMT 2025 , Edited by admin on Wed Apr 02 21:04:20 GMT 2025
PRIMARY
EPA CompTox
DTXSID00517966
Created by admin on Wed Apr 02 21:04:20 GMT 2025 , Edited by admin on Wed Apr 02 21:04:20 GMT 2025
PRIMARY
PUBCHEM
13093919
Created by admin on Wed Apr 02 21:04:20 GMT 2025 , Edited by admin on Wed Apr 02 21:04:20 GMT 2025
PRIMARY
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