methyl 7alpha,12alpha-dihydroxy-3-oxo-5beta-cholan-24-oate

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Names

[ CAS No. ]:
14772-99-7

[ Name ]:
methyl 7alpha,12alpha-dihydroxy-3-oxo-5beta-cholan-24-oate

[Synonym ]:
Methyl 7,12-dihydroxy-3-oxocholan-24-oate
Methyl 7alpha,12alpha-dihydroxy-3-oxo-5beta-cholan-24-oate
EINECS 238-839-1

Chemical & Physical Properties

[ Density]:
1.137g/cm3

[ Boiling Point ]:
540ºC at 760 mmHg

[ Molecular Formula ]:
C25H40O5

[ Molecular Weight ]:
420.58200

[ Flash Point ]:
175.1ºC

[ Exact Mass ]:
420.28800

[ PSA ]:
83.83000

[ LogP ]:
3.74530

[ Vapour Pressure ]:
6.52E-14mmHg at 25°C

[ Index of Refraction ]:
1.532

Synthetic Route

Precursor & DownStream

Precursor

  • Methyl Cholate
  • methyl 3-oxo-7α,12α-dihydroxy-1,4-choladienate
  • cholic acid
  • Acetone
  • Methanol
  • 3-​Oxocholic acid
  • aluminum phenoxide
  • benzene
  • ALUMINUM TERT-BUTANOLATE

DownStream

  • Methyl Cholate
  • Methyl 3-Keto-7α,12α-dihydroxy-5α-cholanoate