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

Details

Stereochemistry ABSOLUTE
Molecular Formula C3H8ClNO
Molecular Weight 109.555
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-AMINO-3-CHLORO-2-PROPANOL, (S)-

SMILES

NC[C@H](O)CCl

InChI

InChIKey=CYJBWQFWXJKKMS-GSVOUGTGSA-N
InChI=1S/C3H8ClNO/c4-1-3(6)2-5/h3,6H,1-2,5H2/t3-/m1/s1

HIDE SMILES / InChI

Molecular Formula C3H8ClNO
Molecular Weight 109.555
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 Mon Mar 31 23:13:13 GMT 2025
Edited
by admin
on Mon Mar 31 23:13:13 GMT 2025
Record UNII
EWM6ZIT38N
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(2S)-1-AMINO-3-CHLOROPROPAN-2-OL
Preferred Name English
1-AMINO-3-CHLORO-2-PROPANOL, (S)-
Systematic Name English
L-1-AMINO-3-CHLORO-2-PROPANOL
Systematic Name English
(2S)-3-CHLOROPROPANE-2-HYDROXY-1-AMINE
Systematic Name English
1-AMINO-3-CHLORO-2-PROPANOL, (+)-
Systematic Name English
2-PROPANOL, 1-AMINO-3-CHLORO-, (2S)-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID20201698
Created by admin on Mon Mar 31 23:13:13 GMT 2025 , Edited by admin on Mon Mar 31 23:13:13 GMT 2025
PRIMARY
PUBCHEM
148643
Created by admin on Mon Mar 31 23:13:13 GMT 2025 , Edited by admin on Mon Mar 31 23:13:13 GMT 2025
PRIMARY
CAS
53494-57-8
Created by admin on Mon Mar 31 23:13:13 GMT 2025 , Edited by admin on Mon Mar 31 23:13:13 GMT 2025
PRIMARY
FDA UNII
EWM6ZIT38N
Created by admin on Mon Mar 31 23:13:13 GMT 2025 , Edited by admin on Mon Mar 31 23:13:13 GMT 2025
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT