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

Details

Stereochemistry ACHIRAL
Molecular Formula C5H9ClO2
Molecular Weight 136.577
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ISOPROPYL CHLOROACETATE

SMILES

CC(C)OC(=O)CCl

InChI

InChIKey=VODRWDBLLGYRJT-UHFFFAOYSA-N
InChI=1S/C5H9ClO2/c1-4(2)8-5(7)3-6/h4H,3H2,1-2H3

HIDE SMILES / InChI

Approval Year

Name Type Language
NSC-27789
Preferred Name English
ISOPROPYL CHLOROACETATE
Systematic Name English
ACETIC ACID, 2-CHLORO-, 1-METHYLETHYL ESTER
Systematic Name English
CHLOROACETIC ACID ISOPROPYL ESTER
Systematic Name English
ACETIC ACID, CHLORO-, 1-METHYLETHYL ESTER
Systematic Name English
Code System Code Type Description
CAS
105-48-6
Created by admin on Mon Mar 31 20:56:45 GMT 2025 , Edited by admin on Mon Mar 31 20:56:45 GMT 2025
PRIMARY
EPA CompTox
DTXSID6059316
Created by admin on Mon Mar 31 20:56:45 GMT 2025 , Edited by admin on Mon Mar 31 20:56:45 GMT 2025
PRIMARY
NSC
27789
Created by admin on Mon Mar 31 20:56:45 GMT 2025 , Edited by admin on Mon Mar 31 20:56:45 GMT 2025
PRIMARY
ECHA (EC/EINECS)
203-301-7
Created by admin on Mon Mar 31 20:56:45 GMT 2025 , Edited by admin on Mon Mar 31 20:56:45 GMT 2025
PRIMARY
FDA UNII
VNJ65NL2TF
Created by admin on Mon Mar 31 20:56:45 GMT 2025 , Edited by admin on Mon Mar 31 20:56:45 GMT 2025
PRIMARY
PUBCHEM
7759
Created by admin on Mon Mar 31 20:56:45 GMT 2025 , Edited by admin on Mon Mar 31 20:56:45 GMT 2025
PRIMARY