Chlorobutadiene

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Properties Simple | Detailed

Formula C4H5Cl
IUPAC Name (1e)-1-chlorobuta-1,3-diene
Molecular Mass 88.536 g·mol−1
Heat of Formation 78.8 ± 16.7 kJ·mol−1
Dipole Moment 1.99 ± 1.08 D
Volume 111.59 Å 3
Surface Area 127.36 Å 2
HOMO Energy -9.67 ± 0.55 eV
LUMO Energy 2.60 ± eV
Point Group Symmetry Cs
Synonyms
  • (1e)-1-chlorobuta-1,3-diene
  • 1,3-butadiene, 1-chloro-
  • 1-chloro-1,3-butadiene
  • 1-chlorobuta-1,3-diene
  • 1-chlorobutadiene
  • 1-chloroprene
  • trans-1-chloro-1,3-butadiene
CAS Number(s)
  • 627-22-5
InChIKey PCPYTNCQOSFKGG-ONEGZZNKSA-N
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Elements H C Cl