2-[(2-Chloroethyl)(Ethyl)Amino]Ethyl Acetate

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Properties Simple | Detailed

Formula C8H16ClNO2
IUPAC Name 2-[2-chloroethyl(ethyl)amino]ethyl acetate
Molecular Mass 193.671 g·mol−1
Heat of Formation -479.1 ± 16.7 kJ·mol−1
Dipole Moment 4.55 ± 1.08 D
Volume 243.06 Å 3
Surface Area 236.93 Å 2
HOMO Energy -9.31 ± 0.55 eV
LUMO Energy 0.82 ± eV
Point Group Symmetry C1
Synonyms
  • 2-(2-chloroethyl-ethyl-amino)ethyl acetate
  • 2-(2-chloroethyl-ethyl-amino)ethyl ethanoate
  • 2-(2-chloroethyl-ethylamino)ethyl acetate
  • acetic acid 2-(2-chloroethyl-ethyl-amino)ethyl ester
  • acetic acid 2-(2-chloroethyl-ethylamino)ethyl ester
  • acetylethylcholine mustard
  • aech-m
  • ethanol, 2-((2-chloroethyl)ethylamino)-, acetate (ester)
CAS Number(s)
  • 98812-27-2
InChIKey UNAXSEJHNLEOKE-UHFFFAOYSA-N
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Elements H C N O Cl