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Details

Stereochemistry RACEMIC
Molecular Formula C4H12N2
Molecular Weight 88.1515
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,3-BUTANEDIAMINE

SMILES

CC(N)CCN

InChI

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

HIDE SMILES / InChI

Molecular Formula C4H12N2
Molecular Weight 88.1515
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:36:03 GMT 2023
Edited
by admin
on Sat Dec 16 11:36:03 GMT 2023
Record UNII
Z1263602CV
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1,3-BUTANEDIAMINE
Systematic Name English
1,3-DIAMINOBUTANE
Systematic Name English
(±)-BUTANE-1,3-DIAMINE
Systematic Name English
NSC-13184
Code English
1-METHYL-1,3-PROPANEDIAMINE
Systematic Name English
J35.125C
Code English
Code System Code Type Description
EPA CompTox
DTXSID20870641
Created by admin on Sat Dec 16 11:36:03 GMT 2023 , Edited by admin on Sat Dec 16 11:36:03 GMT 2023
PRIMARY
PUBCHEM
61136
Created by admin on Sat Dec 16 11:36:03 GMT 2023 , Edited by admin on Sat Dec 16 11:36:03 GMT 2023
PRIMARY
NSC
13184
Created by admin on Sat Dec 16 11:36:03 GMT 2023 , Edited by admin on Sat Dec 16 11:36:03 GMT 2023
PRIMARY
FDA UNII
Z1263602CV
Created by admin on Sat Dec 16 11:36:03 GMT 2023 , Edited by admin on Sat Dec 16 11:36:03 GMT 2023
PRIMARY
CAS
590-88-5
Created by admin on Sat Dec 16 11:36:03 GMT 2023 , Edited by admin on Sat Dec 16 11:36:03 GMT 2023
PRIMARY
ECHA (EC/EINECS)
209-692-0
Created by admin on Sat Dec 16 11:36:03 GMT 2023 , Edited by admin on Sat Dec 16 11:36:03 GMT 2023
PRIMARY
Related Record Type Details
ENANTIOMER -> RACEMATE
ENANTIOMER -> RACEMATE