1-Cyanopropene

Molecule SVG Image

Properties Simple | Detailed

Formula C4H5N
IUPAC Name (z)-but-2-enenitrile
Molecular Mass 67.089 g·mol−1
Heat of Formation 138.1 ± 16.7 kJ·mol−1
Dipole Moment 4.26 ± 1.08 D
Volume 98.47 Å 3
Surface Area 114.66 Å 2
HOMO Energy -10.68 ± 0.55 eV
LUMO Energy -0.65 ± eV
Point Group Symmetry Cs
Synonyms
  • (2z)-but-2-enenitrile
  • (z)-2-butenenitrile
  • (z)-but-2-enenitrile
  • (z)-ch3ch=chcn
  • (z)-crotononitrile
  • 2-butenenitrile, (2z)-
  • 2-butenenitrile, (z)-
  • cis-1-propenyl cyanide
  • cis-2-butenenitrile
  • cis-beta-methylacrylonitrile
  • cis-crotononitrile
  • cis-cyanopropene
  • crotononitrile, (z)- (8ci)
  • isocrotonic nitrile
  • isocrotononitrile (6ci,7ci)
CAS Number(s)
  • 1190-76-7
InChIKey NKKMVIVFRUYPLQ-IHWYPQMZSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C N