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Details

Stereochemistry ABSOLUTE
Molecular Formula C4H12N2
Molecular Weight 88.1515
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,3-BUTANEDIAMINE, (S)-

SMILES

C[C@H](N)CCN

InChI

InChIKey=RGTXVXDNHPWPHH-BYPYZUCNSA-N
InChI=1S/C4H12N2/c1-4(6)2-3-5/h4H,2-3,5-6H2,1H3/t4-/m0/s1

HIDE SMILES / InChI

Molecular Formula C4H12N2
Molecular Weight 88.1515
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:21:40 GMT 2023
Edited
by admin
on Sat Dec 16 08:21:40 GMT 2023
Record UNII
982SQ392CR
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1,3-BUTANEDIAMINE, (S)-
Systematic Name English
1,3-BUTANEDIAMINE, (S)-(+)-
Systematic Name English
D-1,3-BUTANEDIAMINE
Common Name English
1,3-BUTANEDIAMINE, (3S)-
Systematic Name English
J63.442E
Code English
Code System Code Type Description
CAS
25139-83-7
Created by admin on Sat Dec 16 08:21:40 GMT 2023 , Edited by admin on Sat Dec 16 08:21:40 GMT 2023
PRIMARY
EPA CompTox
DTXSID60427375
Created by admin on Sat Dec 16 08:21:40 GMT 2023 , Edited by admin on Sat Dec 16 08:21:40 GMT 2023
PRIMARY
PUBCHEM
55290147
Created by admin on Sat Dec 16 08:21:40 GMT 2023 , Edited by admin on Sat Dec 16 08:21:40 GMT 2023
PRIMARY
FDA UNII
982SQ392CR
Created by admin on Sat Dec 16 08:21:40 GMT 2023 , Edited by admin on Sat Dec 16 08:21:40 GMT 2023
PRIMARY
Related Record Type Details
RACEMATE -> ENANTIOMER