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Details

Stereochemistry ACHIRAL
Molecular Formula C5H7N
Molecular Weight 81.1158
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of METHYL-2-BUTENENITRILE, (2Z)-

SMILES

C\C=C(\C)C#N

InChI

InChIKey=IHXNSHZBFXGOJM-HYXAFXHYSA-N
InChI=1S/C5H7N/c1-3-5(2)4-6/h3H,1-2H3/b5-3-

HIDE SMILES / InChI

Molecular Formula C5H7N
Molecular Weight 81.1158
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 Mon Mar 31 21:44:01 GMT 2025
Edited
by admin
on Mon Mar 31 21:44:01 GMT 2025
Record UNII
RKI9CB99KR
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
HSDB-6156
Preferred Name English
METHYL-2-BUTENENITRILE, (2Z)-
Systematic Name English
ANGELONITRILE
Systematic Name English
ANGELIC ACID NITRILE
Common Name English
CIS-2-METHYL-2-BUTENONITRILE
Systematic Name English
CROTONONITRILE, 2-METHYL-, (Z)-
Systematic Name English
ANGELICONITRILE
Common Name English
CIS-2-METHYL-2-BUTENENITRILE
Systematic Name English
(Z)-2-METHYL-2-BUTENENITRILE
Systematic Name English
2-BUTENENITRILE, 2-METHYL-, (Z)-
Systematic Name English
2-BUTENENITRILE, 2-METHYL-, (2Z)-
Systematic Name English
2-METHYL-CIS-2-BUTENENITRILE
Systematic Name English
Code System Code Type Description
HSDB
6156
Created by admin on Mon Mar 31 21:44:01 GMT 2025 , Edited by admin on Mon Mar 31 21:44:01 GMT 2025
PRIMARY
FDA UNII
RKI9CB99KR
Created by admin on Mon Mar 31 21:44:01 GMT 2025 , Edited by admin on Mon Mar 31 21:44:01 GMT 2025
PRIMARY
EPA CompTox
DTXSID5027807
Created by admin on Mon Mar 31 21:44:01 GMT 2025 , Edited by admin on Mon Mar 31 21:44:01 GMT 2025
PRIMARY
CAS
20068-02-4
Created by admin on Mon Mar 31 21:44:01 GMT 2025 , Edited by admin on Mon Mar 31 21:44:01 GMT 2025
PRIMARY
ECHA (EC/EINECS)
243-496-6
Created by admin on Mon Mar 31 21:44:01 GMT 2025 , Edited by admin on Mon Mar 31 21:44:01 GMT 2025
PRIMARY
PUBCHEM
6028739
Created by admin on Mon Mar 31 21:44:01 GMT 2025 , Edited by admin on Mon Mar 31 21:44:01 GMT 2025
PRIMARY