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

Details

Stereochemistry ACHIRAL
Molecular Formula C6H12N2O2
Molecular Weight 144.1717
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1-(METHYLNITROSOAMINO)-2-PENTANONE

SMILES

CCCC(=O)CN(C)N=O

InChI

InChIKey=REFUCZDQFDBMIC-UHFFFAOYSA-N
InChI=1S/C6H12N2O2/c1-3-4-6(9)5-8(2)7-10/h3-5H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C6H12N2O2
Molecular Weight 144.1717
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 22:26:06 GMT 2025
Edited
by admin
on Mon Mar 31 22:26:06 GMT 2025
Record UNII
8C8Z0OI78C
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-(METHYLNITROSOAMINO)-2-PENTANONE
Systematic Name English
CCRIS 7864
Preferred Name English
2-PENTANONE, 1-(METHYLNITROSOAMINO)-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID40171647
Created by admin on Mon Mar 31 22:26:06 GMT 2025 , Edited by admin on Mon Mar 31 22:26:06 GMT 2025
PRIMARY
CAS
184699-18-1
Created by admin on Mon Mar 31 22:26:06 GMT 2025 , Edited by admin on Mon Mar 31 22:26:06 GMT 2025
PRIMARY
PUBCHEM
154830
Created by admin on Mon Mar 31 22:26:06 GMT 2025 , Edited by admin on Mon Mar 31 22:26:06 GMT 2025
PRIMARY
FDA UNII
8C8Z0OI78C
Created by admin on Mon Mar 31 22:26:06 GMT 2025 , Edited by admin on Mon Mar 31 22:26:06 GMT 2025
PRIMARY