2-{4-[(1Z)-1,2-Diphenyl-1-Buten-1-Yl]Phenoxy}Ethyl (2-Chloroethyl)Carbamate

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Properties Simple | Detailed

Formula C27H28ClNO3
IUPAC Name 2-[4-[(z)-1,2-diphenylbut-1-enyl]phenoxy]ethyl n-(2-chloroethyl)carbamate
Molecular Mass 449.969 g·mol−1
Heat of Formation -54.6 ± 16.7 kJ·mol−1
Dipole Moment 1.57 ± 1.08 D
Volume 529.27 Å 3
Surface Area 401.79 Å 2
HOMO Energy -8.56 ± 0.55 eV
LUMO Energy -0.04 ± eV
Point Group Symmetry C1
Synonyms
  • 2-[4-[(z)-1,2-di(phenyl)but-1-enyl]phenoxy]ethyl n-(2-chloroethyl)carbamate
  • carbamic acid, (2-chloroethyl)-, 2-(4-(1,2-diphenyl-1-butenyl)phenoxy)ethyl ester, (z)-
  • n-(2-chloroethyl)-2-(4-(1,2-diphenylbutenyl)phenoxy)ethyl carbamate
  • n-(2-chloroethyl)carbamic acid 2-[4-[(z)-1,2-di(phenyl)but-1-enyl]phenoxy]ethyl ester
  • n-chloroethyl-dbpe-carbamate
CAS Number(s)
  • 104691-76-1
InChIKey WBVGVPAUUQPWMR-QPLCGJKRSA-N
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