2-(Diethylamino)Ethyl 4-Amino-5-Chloro-2-Methoxybenzoate

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Properties Simple | Detailed

Formula C14H21ClN2O3
IUPAC Name 2-(diethylamino)ethyl 4-amino-5-chloro-2-methoxy-benzoate
Molecular Mass 300.781 g·mol−1
Heat of Formation -512.5 ± 16.7 kJ·mol−1
Dipole Moment 3.21 ± 1.08 D
Volume 361.26 Å 3
Surface Area 330.25 Å 2
HOMO Energy -8.86 ± 0.55 eV
LUMO Energy -0.29 ± eV
Point Group Symmetry C1
Synonyms
  • 2-diethylaminoethyl 4-amino-5-chloro-2-methoxy-benzoate
  • 2-diethylaminoethyl 4-amino-5-chloro-2-methoxybenzoate
  • 2-methoxy-4-amino-5-chlorobenzoic acid 2-(diethylamino)ethyl ester
  • 4-amino-5-chloro-2-methoxy-benzoic acid 2-diethylaminoethyl ester
  • 4-amino-5-chloro-2-methoxybenzoic acid 2-diethylaminoethyl ester
  • benzoic acid, 4-amino-5-chloro-2-methoxy-, 2-(diethylamino)ethyl ester
  • biomol-nt_000157
  • bpbio1_000574
  • pdsp1_001668
  • pdsp2_001652
  • sdz 205,557
  • sdz 205-557
CAS Number(s)
  • 137196-67-9
InChIKey FFNWMBDISAYHDC-UHFFFAOYSA-N
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Elements H C N O Cl