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Details

Stereochemistry ACHIRAL
Molecular Formula C21H42N2
Molecular Weight 322.5716
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-OCTADECYLAMINOPROPIONONITRILE

SMILES

CCCCCCCCCCCCCCCCCCNCCC#N

InChI

InChIKey=GUBPKKGRODRXPY-UHFFFAOYSA-N
InChI=1S/C21H42N2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-23-21-18-19-22/h23H,2-18,20-21H2,1H3

HIDE SMILES / InChI

Molecular Formula C21H42N2
Molecular Weight 322.5716
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 Sat Dec 16 12:22:38 GMT 2023
Edited
by admin
on Sat Dec 16 12:22:38 GMT 2023
Record UNII
7D35H74NQX
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-OCTADECYLAMINOPROPIONONITRILE
Systematic Name English
NSC-5848
Code English
PROPANENITRILE, 3-(OCTADECYLAMINO)-
Systematic Name English
Code System Code Type Description
FDA UNII
7D35H74NQX
Created by admin on Sat Dec 16 12:22:38 GMT 2023 , Edited by admin on Sat Dec 16 12:22:38 GMT 2023
PRIMARY
CAS
6281-72-7
Created by admin on Sat Dec 16 12:22:38 GMT 2023 , Edited by admin on Sat Dec 16 12:22:38 GMT 2023
PRIMARY
NSC
5848
Created by admin on Sat Dec 16 12:22:38 GMT 2023 , Edited by admin on Sat Dec 16 12:22:38 GMT 2023
PRIMARY
EPA CompTox
DTXSID9075400
Created by admin on Sat Dec 16 12:22:38 GMT 2023 , Edited by admin on Sat Dec 16 12:22:38 GMT 2023
PRIMARY
ECHA (EC/EINECS)
228-494-5
Created by admin on Sat Dec 16 12:22:38 GMT 2023 , Edited by admin on Sat Dec 16 12:22:38 GMT 2023
PRIMARY
PUBCHEM
80490
Created by admin on Sat Dec 16 12:22:38 GMT 2023 , Edited by admin on Sat Dec 16 12:22:38 GMT 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT