[(2S,3R,5aS,9aR)-3-hydroxy-2,3,4,5,5a,6,7,8,9,9a-decahydrobenzo[b]oxepin-2-yl]methyl 2,4-dichlorobenzoate

Names

[ CAS No. ]:
101859-07-8

[ Name ]:
[(2S,3R,5aS,9aR)-3-hydroxy-2,3,4,5,5a,6,7,8,9,9a-decahydrobenzo[b]oxepin-2-yl]methyl 2,4-dichlorobenzoate

[Synonym ]:
Benzoic acid,2,4-dichloro-,(decahydro-3-hydroxy-1-benzoxepin-2-yl)methyl ester,(2alpha,3beta,5aalpha,9abeta)
(1R*,3S*,4R*,7S*)-3-{[(2,4-dichlorobenzoyl)oxy]-methyl}-2-oxabicyclo[5.4.0.]undecan-4-ol

Chemical & Physical Properties

[ Density]:
1.28g/cm3

[ Boiling Point ]:
501.4ºC at 760mmHg

[ Molecular Formula ]:
C18H22Cl2O4

[ Molecular Weight ]:
373.27100

[ Flash Point ]:
257ºC

[ Exact Mass ]:
372.09000

[ PSA ]:
55.76000

[ LogP ]:
4.24890

[ Vapour Pressure ]:
7.11E-11mmHg at 25°C

[ Index of Refraction ]:
1.552

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • [(2S)-2-[(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-2H-chromen-2-yl]-2-iodoethyl] 2,4-dichlorobenzoate
  • N,N-Dimethylformamide
  • Cyclohexene oxide
  • syn-2-(but-3-enyl)cyclohexanol
  • 1-bromo-4-[[(1R,2S)-2-but-3-enylcyclohexyl]oxymethyl]benzene
  • 3-[(1S,2R)-2-[(4-bromophenyl)methoxy]cyclohexyl]propanal
  • (E)-5-[(1R,2S)-2-[(4-bromophenyl)methoxy]cyclohexyl]pent-2-en-1-ol
  • methyl (Z)-5-[(1R,2S)-2-[(4-bromophenyl)methoxy]cyclohexyl]pent-2-enoate
  • 1-[[(1R,2S)-2-but-3-enylcyclohexyl]oxy-(4-chlorophenyl)methyl]-4-chlorobenzene
  • 3-[(1S,2R)-2-[bis(4-chlorophenyl)methoxy]cyclohexyl]propanal

DownStream

Related Compounds

  • 1-(But-3-yn-2-yl)-1-methylcyclohexane
  • 2-[4-(6-Oxo-3-phenyldiazinan-4-yl)piperazin-1-yl]pyrimidine-4-carbonitrile
  • 6-(5-Quinoxalin-2-yl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-2-yl)-1,3-diazinane-2,4-dione
  • 3-[1-(1H-indole-5-carbonyl)piperidin-4-yl]-4aH-pyrido[2,3-d]pyrimidine-2,4-dione
  • N-[[8-(3-methyl-1,2,4-oxadiazol-5-yl)-[1,2,4]triazolo[4,3-a]pyridin-3-yl]methyl]-6-oxo-3H-pyridazine-3-carboxamide
  • 6-[4-[(2-Cyclopropylimidazo[1,2-b]pyridazin-6-yl)oxymethyl]piperidine-1-carbonyl]piperidin-2-one
  • 5-(Cyclopropylmethyl)-2-(4-ethylphenyl)-1,2,3,3a-tetrahydropyrazolo[1,5-a]pyrazin-4-one
  • 5-[4-[(3-Methyl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]-6-phenyldiazinan-3-one
  • [3-[(3-Cyclopropyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)oxymethyl]pyrrolidin-1-yl]-pyrazolidin-4-ylmethanone
  • N-[2-(2,4-dioxo-4a,7a-dihydro-1H-thieno[3,2-d]pyrimidin-3-yl)ethyl]-1-methyl-2-oxopyridine-3-carboxamide
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