(1R,2R)-2-(1-Pyrrolidinyl)Cyclohexyl [3-(Pentyloxy)Phenyl]Carbamate

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Properties Simple | Detailed

Formula C22H34N2O3
IUPAC Name [(1r,2r)-2-pyrrolidin-1-ylcyclohexyl] n-(3-pentoxyphenyl)carbamate
Molecular Mass 374.517 g·mol−1
Heat of Formation -589.5 ± 16.7 kJ·mol−1
Dipole Moment 2.13 ± 1.08 D
Volume 478.92 Å 3
Surface Area 429.89 Å 2
HOMO Energy -8.59 ± 0.55 eV
LUMO Energy 0.12 ± eV
Point Group Symmetry C1
Synonyms
  • 2-(1-pyrrolidinyl)cyclohexyl 3-pentyloxycarbanilic acid ester
  • [(1r,2r)-2-pyrrolidin-1-ylcyclohexyl] n-(3-pentoxyphenyl)carbamate
  • carbamic acid, (3-(pentyloxy)phenyl)-, (1r,2r)-2-(1-pyrrolidinyl)cyclohexyl ester, rel-
  • carbamic acid, (3-(pentyloxy)phenyl)-, 2-(1-pyrrolidinyl)cyclohexyl ester, trans-
  • k 1902
  • n-(3-amoxyphenyl)carbamic acid [(1r,2r)-2-pyrrolidin-1-ylcyclohexyl] ester
  • n-(3-pentoxyphenyl)carbamic acid [(1r,2r)-2-1-pyrrolidinylcyclohexyl] ester
CAS Number(s)
  • 76875-69-9
InChIKey HVYGHQWGUABUST-NHCUHLMSSA-N
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