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Details

Stereochemistry ABSOLUTE
Molecular Formula C4H8N2.ClH
Molecular Weight 120.581
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-Aminobutanenitrile hydrochloride, (2S)-

SMILES

Cl.CC[C@H](N)C#N

InChI

InChIKey=OJGHKZQRNGOMQR-WCCKRBBISA-N
InChI=1S/C4H8N2.ClH/c1-2-4(6)3-5;/h4H,2,6H2,1H3;1H/t4-;/m0./s1

HIDE SMILES / InChI

Molecular Formula C4H8N2
Molecular Weight 84.1197
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Molecular Formula ClH
Molecular Weight 36.461
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 20:22:30 GMT 2023
Edited
by admin
on Sat Dec 16 20:22:30 GMT 2023
Record UNII
JUB2QAU4L9
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-Aminobutanenitrile hydrochloride, (2S)-
Systematic Name English
Butanenitrile, 2-amino-, hydrochloride (1:1), (2S)-
Systematic Name English
Butanenitrile, 2-amino-, monohydrochloride, (2S)-
Systematic Name English
(2S)-2-Aminobutanenitrile hydrochloride
Common Name English
Code System Code Type Description
FDA UNII
JUB2QAU4L9
Created by admin on Sat Dec 16 20:22:31 GMT 2023 , Edited by admin on Sat Dec 16 20:22:31 GMT 2023
PRIMARY
CAS
887277-58-9
Created by admin on Sat Dec 16 20:22:31 GMT 2023 , Edited by admin on Sat Dec 16 20:22:31 GMT 2023
PRIMARY
Related Record Type Details
ENANTIOMER -> ENANTIOMER
RACEMATE -> ENANTIOMER
PARENT -> SALT/SOLVATE