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

Details

Stereochemistry ACHIRAL
Molecular Formula C5H12N4O2
Molecular Weight 160.1744
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-BUTYL-N'-NITROGUANIDINE

SMILES

CCCCNC(=N)N[N+]([O-])=O

InChI

InChIKey=KPQHRDFCWBWTBA-UHFFFAOYSA-N
InChI=1S/C5H12N4O2/c1-2-3-4-7-5(6)8-9(10)11/h2-4H2,1H3,(H3,6,7,8)

HIDE SMILES / InChI

Molecular Formula C5H12N4O2
Molecular Weight 160.1744
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 Fri Dec 15 17:39:45 GMT 2023
Edited
by admin
on Fri Dec 15 17:39:45 GMT 2023
Record UNII
61HJ0I78X1
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-BUTYL-N'-NITROGUANIDINE
Systematic Name English
BUTYL-N'-NITROGUANIDINE, N-
Systematic Name English
NSC-24640
Code English
GUANIDINE, N-BUTYL-N'-NITRO-
Systematic Name English
GUANIDINE, 1-BUTYL-3-NITRO-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID90203008
Created by admin on Fri Dec 15 17:39:45 GMT 2023 , Edited by admin on Fri Dec 15 17:39:45 GMT 2023
PRIMARY
PUBCHEM
145791
Created by admin on Fri Dec 15 17:39:45 GMT 2023 , Edited by admin on Fri Dec 15 17:39:45 GMT 2023
PRIMARY
NSC
24640
Created by admin on Fri Dec 15 17:39:45 GMT 2023 , Edited by admin on Fri Dec 15 17:39:45 GMT 2023
PRIMARY
FDA UNII
61HJ0I78X1
Created by admin on Fri Dec 15 17:39:45 GMT 2023 , Edited by admin on Fri Dec 15 17:39:45 GMT 2023
PRIMARY
CAS
5458-83-3
Created by admin on Fri Dec 15 17:39:45 GMT 2023 , Edited by admin on Fri Dec 15 17:39:45 GMT 2023
PRIMARY