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Details

Stereochemistry ACHIRAL
Molecular Formula C5H5N
Molecular Weight 79.0999
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 1-CYANO-1,3-BUTADIENE

SMILES

C=C\C=C\C#N

InChI

InChIKey=STSRVFAXSLNLLI-ONEGZZNKSA-N
InChI=1S/C5H5N/c1-2-3-4-5-6/h2-4H,1H2/b4-3+

HIDE SMILES / InChI

Molecular Formula C5H5N
Molecular Weight 79.0999
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 17:50:20 GMT 2023
Edited
by admin
on Fri Dec 15 17:50:20 GMT 2023
Record UNII
53403153MA
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-CYANO-1,3-BUTADIENE
Systematic Name English
2,4-PENTADIENENITRILE, (2E)-
Systematic Name English
NSC-509215
Code English
2,4-PENTADIENENITRILE, TRANS-
Systematic Name English
TRANS-1-CYANOBUTA-1,3-DIENE
Systematic Name English
TRANS-1-CYANOBUTADIENE
Systematic Name English
TRANS-2,4-PENTADIENENITRILE
Common Name English
1,3-BUTADIENE, 1-CYANO-
Systematic Name English
PENTA-2,4-DIENENITRILE
Systematic Name English
2,4-PENTADIENENITRILE, (E)-
Systematic Name English
(2E)-2,4-PENTADIENENITRILE
Common Name English
2,4-PENTADIENENITRILE
Systematic Name English
Code System Code Type Description
CAS
1615-70-9
Created by admin on Fri Dec 15 17:50:20 GMT 2023 , Edited by admin on Fri Dec 15 17:50:20 GMT 2023
NON-SPECIFIC STEREOCHEMISTRY
FDA UNII
53403153MA
Created by admin on Fri Dec 15 17:50:20 GMT 2023 , Edited by admin on Fri Dec 15 17:50:20 GMT 2023
PRIMARY
EPA CompTox
DTXSID8075099
Created by admin on Fri Dec 15 17:50:20 GMT 2023 , Edited by admin on Fri Dec 15 17:50:20 GMT 2023
PRIMARY
PUBCHEM
5364328
Created by admin on Fri Dec 15 17:50:20 GMT 2023 , Edited by admin on Fri Dec 15 17:50:20 GMT 2023
PRIMARY
CAS
2180-68-9
Created by admin on Fri Dec 15 17:50:20 GMT 2023 , Edited by admin on Fri Dec 15 17:50:20 GMT 2023
PRIMARY
ECHA (EC/EINECS)
216-566-9
Created by admin on Fri Dec 15 17:50:20 GMT 2023 , Edited by admin on Fri Dec 15 17:50:20 GMT 2023
PRIMARY
NSC
509215
Created by admin on Fri Dec 15 17:50:20 GMT 2023 , Edited by admin on Fri Dec 15 17:50:20 GMT 2023
PRIMARY