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

Details

Stereochemistry RACEMIC
Molecular Formula C3H6ClFO
Molecular Weight 112.531
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-CHLORO-3-FLUORO-2-PROPANOL

SMILES

OC(CF)CCl

InChI

InChIKey=ZNKJYZHZWALQNX-UHFFFAOYSA-N
InChI=1S/C3H6ClFO/c4-1-3(6)2-5/h3,6H,1-2H2

HIDE SMILES / InChI

Molecular Formula C3H6ClFO
Molecular Weight 112.531
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 19:48:46 GMT 2025
Edited
by admin
on Tue Apr 01 19:48:46 GMT 2025
Record UNII
M52MM3Q8FH
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-21304
Preferred Name English
1-CHLORO-3-FLUORO-2-PROPANOL
Systematic Name English
NSC-80643
Code English
2-PROPANOL, 1-CHLORO-3-FLUORO-
Systematic Name English
Code System Code Type Description
NSC
80643
Created by admin on Tue Apr 01 19:48:46 GMT 2025 , Edited by admin on Tue Apr 01 19:48:46 GMT 2025
PRIMARY
EPA CompTox
DTXSID001309613
Created by admin on Tue Apr 01 19:48:46 GMT 2025 , Edited by admin on Tue Apr 01 19:48:46 GMT 2025
PRIMARY
CAS
453-11-2
Created by admin on Tue Apr 01 19:48:46 GMT 2025 , Edited by admin on Tue Apr 01 19:48:46 GMT 2025
PRIMARY
NSC
21304
Created by admin on Tue Apr 01 19:48:46 GMT 2025 , Edited by admin on Tue Apr 01 19:48:46 GMT 2025
PRIMARY
FDA UNII
M52MM3Q8FH
Created by admin on Tue Apr 01 19:48:46 GMT 2025 , Edited by admin on Tue Apr 01 19:48:46 GMT 2025
PRIMARY
PUBCHEM
92107
Created by admin on Tue Apr 01 19:48:46 GMT 2025 , Edited by admin on Tue Apr 01 19:48:46 GMT 2025
PRIMARY