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Estradiol hemisuccinate

Estradiol hemisuccinate structure

CAS No:
7698-93-3
Formula:
C22H28O5
Chemical Name:
Estradiol hemisuccinate
Synonyms:
Estra-1,3,5(10)-triene-3,17-diol (17β)-,17-(hydrogen butanedioate);Estradiol,17-(hydrogen succinate);Succinic acid,17-monoester with estradiol;Estradiol 17β-hemisuccinate;Estra-1,3,5(10)-triene-3,17β-diol 17-(hydrogen succinate);17β-Estradiol 17-hemisuccinate;Estradiol-17-hemisuccinate;17β-Estradiol succinate;Estradiol hemisuccinate;847232-88-6
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

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Estradiol hemisuccinate Basic Attributes

Molecular Weight：

372.45

Exact Mass：

372.45

EC Number：

300-371-1

UNII：

VQV5064VG6

DSSTox ID：

DTXSID00227770

Characteristics

PSA：

83.83000

XLogP3：

4.64

Density：

1.3±0.1 g/cm3

Melting Point：

150-155 °C

Boiling Point：

570.1±50.0 °C at 760 mmHg

Flash Point：

198.7±23.6 °C

Refractive Index：

1.598

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

hazard class code：

20/21/22-40

safety instructions：

22-36

Marks：

Precautionary statement(s)：

P280

Hazard Statements：

H302-H312-H332-H351

GHS Classification：

|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P201, P202, P261, P264, P270, P271, P280, P281, P301+P312, P302+P352, P304+P312, P304+P340, P308+P313, P312, P322, P330, P363, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Drug Information

MeSH Entry Terms：

17 alpha-estradiol hemisuccinate

Computed Properties

Molecular Weight:372.5
XLogP3:4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:372.19367399
Monoisotopic Mass:372.19367399
Topological Polar Surface Area:83.8
Heavy Atom Count:27
Complexity:589
Defined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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CAS No.: 7698-93-3

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