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1,4-CHOLESTADIEN-3-ONE

1,4-CHOLESTADIEN-3-ONE structure

CAS No:
4117-50-4
Formula:
C27H42O
Chemical Name:
1,4-CHOLESTADIEN-3-ONE
Synonyms:
Cholesta-2,4-diene;CTK1D7444;DTXSID90961479;ZINC98043902;(8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-6,7,8,9,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthrene;Cholesta-2,4-diene(6CI,7CI,8CI,9CI);81546-39-6
Categories:
Organic Chemistry > Ethers and Derivatives

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1,4-CHOLESTADIEN-3-ONE Basic Attributes

Molecular Weight：

382.62200

Exact Mass：

382.32400

Characteristics

PSA：

17.07000

XLogP3：

7.37290

Density：

0.95g/cm3

Boiling Point：

451.3ºC at 760mmHg

Flash Point：

221.9ºC

Refractive Index：

1.508

Computed Properties

Molecular Weight:368.6
XLogP3:9.8
Rotatable Bond Count:5
Exact Mass:368.344301404
Monoisotopic Mass:368.344301404
Heavy Atom Count:27
Complexity:595
Defined Atom Stereocenter Count:7
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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1,4-CHOLESTADIEN-3-ONE

CAS No.: 4117-50-4

Grade: Industrial Grade

Content: 99.0%

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