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Cholesteryl erucate

Cholesteryl erucate structure

Cholesteryl erucate 

structure
  • CAS No:

    24516-39-0

  • Formula:

    C49H86O2

  • Chemical Name:

    Cholesteryl erucate

  • Synonyms:

    Cholest-5-en-3-ol (3β)-,3-(13Z)-13-docosenoate;Cholesterol,13-docosenoate,(Z)-;Cholest-5-en-3-ol (3β)-,13-docosenoate,(Z)-;Cholesterol,13-docosenoate;Cholest-5-en-3-ol (3β)-,(13Z)-13-docosenoate;13-Docosenoic acid,cholesteryl ester,(Z)-;Cholesteryl erucate;Cholesterol erucate;Cholesteryl cis-13-docosenoate

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

Cholesteryl erucate Basic Attributes

707.21

707.21

246-292-5

Characteristics

26.30000

15.53750

0.95g/cm3

710.2ºC at 760mmHg

384.6ºC

1.509

−20°C

Safety Information

NONH for all modes of transport

3

Cholesteryl erucate Use and Manufacturing

Cholest-5-en-3-ol (3.beta.)-, 3-(13Z)-13-docosenoate: INACTIVE

Computed Properties

Molecular Weight:707.2
XLogP3:18.8
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:26
Exact Mass:706.66278198
Monoisotopic Mass:706.66278198
Topological Polar Surface Area:26.3
Heavy Atom Count:51
Complexity:1040
Undefined Atom Stereocenter Count:8
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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