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

Details

Stereochemistry ACHIRAL
Molecular Formula C5H9ClN2O3
Molecular Weight 180.59
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (2-CHLOROETHYL-NITROSOAMINO)METHYL ACETATE

SMILES

CC(=O)OCN(CCCl)N=O

InChI

InChIKey=SAGGAEIWSXFESE-UHFFFAOYSA-N
InChI=1S/C5H9ClN2O3/c1-5(9)11-4-8(7-10)3-2-6/h2-4H2,1H3

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
(2-CHLOROETHYL-NITROSOAMINO)METHYL ACETATE
Systematic Name English
((2-CHLOROETHYL)(NITROSO)AMINO)METHYL ACETATE
Preferred Name English
N-NITROSO-N-(ACETOXYMETHYL)-2-CHLOROETHYLAMINE
Systematic Name English
METHANOL, 1-((2-CHLOROETHYL)NITROSOAMINO)-, 1-ACETATE
Systematic Name English
Code System Code Type Description
PUBCHEM
3018639
Created by admin on Mon Mar 31 22:02:30 GMT 2025 , Edited by admin on Mon Mar 31 22:02:30 GMT 2025
PRIMARY
EPA CompTox
DTXSID60997568
Created by admin on Mon Mar 31 22:02:30 GMT 2025 , Edited by admin on Mon Mar 31 22:02:30 GMT 2025
PRIMARY
FDA UNII
SM8PU5X6JW
Created by admin on Mon Mar 31 22:02:30 GMT 2025 , Edited by admin on Mon Mar 31 22:02:30 GMT 2025
PRIMARY
CAS
76215-00-4
Created by admin on Mon Mar 31 22:02:30 GMT 2025 , Edited by admin on Mon Mar 31 22:02:30 GMT 2025
PRIMARY
NIH
NCATS
PRIVACY NOTICE
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966