2-[(2-Chloroethyl)(Methyl)Amino]Ethyl 4-Ethoxybenzoate

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Properties Simple | Detailed

Formula C14H20ClNO3
IUPAC Name 2-[2-chloroethyl(methyl)amino]ethyl 4-ethoxybenzoate
Molecular Mass 285.767 g·mol−1
Heat of Formation -517.4 ± 16.7 kJ·mol−1
Dipole Moment 5.07 ± 1.08 D
Volume 348.13 Å 3
Surface Area 327.36 Å 2
HOMO Energy -9.22 ± 0.55 eV
LUMO Energy -0.43 ± eV
Point Group Symmetry C1
Synonyms
  • 2-((2-chloroethyl)methylamino)ethyl-4-ethoxybenzoate
  • 2-(2-chloroethyl-methyl-amino)ethyl 4-ethoxybenzoate
  • 2-(2-chloroethyl-methylamino)ethyl 4-ethoxybenzoate
  • 4-ethoxybenzoic acid 2-(2-chloroethyl-methyl-amino)ethyl ester
  • 4-ethoxybenzoic acid 2-(2-chloroethyl-methylamino)ethyl ester
  • benzoic acid, 4-ethoxy-, 2-((2-chloroethyl)methylamino)ethyl ester
CAS Number(s)
  • 31702-62-2
InChIKey CPFGUDVOGXCXKG-UHFFFAOYSA-N
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Elements H C N O Cl