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Vitamin D5

Vitamin D5 structure

Vitamin D5 

structure
  • CAS No:

    71761-06-3

  • Formula:

    C29H48O

  • Chemical Name:

    Vitamin D5

  • Synonyms:

    Cyclohexanol,5-[(2E)-2-[(1R,3aS,7aR)-1-[(1R,4R)-4-ethyl-1,5-dimethylhexyl]octahydro-7a-methyl-4H-inden-4-ylidene]ethylidene]-4-methylene-,(1S,5Z)-;9,10-Secostigmasta-5,7,10(19)-trien-3-ol,(3β,5Z,7E)-;(1S,5Z)-5-[(2E)-2-[(1R,3aS,7aR)-1-[(1R,4R)-4-Ethyl-1,5-dimethylhexyl]octahydro-7a-methyl-4H-inden-4-ylidene]ethylidene]-4-methylenecyclohexanol;Vitamin D5;24R-Methylcalciol;Sitocalciferol

  • Categories:

    Pharmaceutical Intermediates  >  Bulk Drug Intermediates

Description

Vitamin D5 is a vitamin D in which the side-chain at position 17 consists of a (5R)-5-ethyl-6-methylheptan-2-yl group.

Vitamin D5 Basic Attributes

412.69100

412.69

0W2I161LCL

Characteristics

20.23000

8.25510

0.96g/cm3

105-106 °C

517ºC at 760 mmHg

225.1ºC

1.519

Computed Properties

Molecular Weight:412.7
XLogP3:8.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:7
Exact Mass:412.370516150
Monoisotopic Mass:412.370516150
Topological Polar Surface Area:20.2
Heavy Atom Count:30
Complexity:653
Defined Atom Stereocenter Count:6
Defined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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