1-(2-{4-[(3R,4S)-7-Methoxy-3-Phenyl-3,4-Dihydro-2H-Chromen-4-Yl]Phenoxy}Ethyl)Pyrrolidine

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Properties Simple | Detailed

Formula C28H31NO3
IUPAC Name 1-[2-[4-[(3r,4s)-7-methoxy-3-phenyl-chroman-4-yl]phenoxy]ethyl]pyrrolidine
Molecular Mass 429.551 g·mol−1
Heat of Formation -232.4 ± 16.7 kJ·mol−1
Dipole Moment 3.45 ± 1.08 D
Volume 532.1 Å 3
Surface Area 449.99 Å 2
HOMO Energy -8.61 ± 0.55 eV
LUMO Energy 3.22 ± eV
Point Group Symmetry C1
Synonyms
  • (z)-1-(2-(4-(3,4-dihydro-7-methoxy-3-phenyl-2h-1-benzopyran-4-yl)phenoxy)ethyl)pyrrolidine
  • 1-[2-[4-[(3r,4s)-7-methoxy-3-phenyl-4-chromanyl]phenoxy]ethyl]pyrrolidine
  • 1-[2-[4-[(3r,4s)-7-methoxy-3-phenyl-chroman-4-yl]phenoxy]ethyl]pyrrolidine
  • 1-[2-[4-[(3r,4s)-7-methoxy-3-phenylchroman-4-yl]phenoxy]ethyl]pyrrolidine
  • pyrrolidine, 1-(2-(4-(3,4-dihydro-7-methoxy-3-phenyl-2h-1-benzopyran-4-yl)phenoxy)ethyl)-, (z)-
CAS Number(s)
  • 33382-06-8
InChIKey SKXCQODDFFKXHF-XCZPVHLTSA-N
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