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Estra-1,3,5(10)-trien-17-one

Estra-1,3,5(10)-trien-17-one structure

CAS No:
53-45-2
Formula:
C18H22O
Chemical Name:
Estra-1,3,5(10)-trien-17-one
Synonyms:
Estra-1,3,5(10)-trien-17-one;Estratrien-17-one;Estrone,3-deoxy-;3-Deoxyestrone;Desoxyestrone;Deoxyestrone;Adopron;Agrestin;NSC 22195

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Description

3-Deoxyestrone is a steroid. It derives from a hydride of an estrane.

Estra-1,3,5(10)-trien-17-one Basic Attributes

Molecular Weight：

254.373

Exact Mass：

254.37

UNII：

M8WJ87C2AC

NSC Number：

22195

DSSTox ID：

DTXSID4022498

Characteristics

PSA：

17.1

XLogP3：

4.11180

Density：

1.088g/cm3

Melting Point：

142-144 °C @ Solvent: Methanol

Boiling Point：

387ºC at 760mmHg

Flash Point：

167.8ºC

Refractive Index：

1.565

Drug Information

MeSH Entry Terms：

3-deoxyestrone

Computed Properties

Molecular Weight:254.4
XLogP3:3.5
Hydrogen Bond Acceptor Count:1
Exact Mass:254.167065321
Monoisotopic Mass:254.167065321
Topological Polar Surface Area:17.1
Heavy Atom Count:19
Complexity:387
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of Estra-1,3,5(10)-trien-17-one

Description
Basic Attributes
Characteristics
Drug Information
Computed Properties

Estra-1,3,5(10)-trien-17-one

SDS

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