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Pregna-1,4-diene-3,20-dione,9-fluoro-11,17,21-trihydroxy-,(5Z,9alpha,11alpha,13E)

Pregna-1,4-diene-3,20-dione,9-fluoro-11,17,21-trihydroxy-,(5Z,9alpha,11alpha,13E) structure

CAS No:
100311-08-8
Formula:
C32H39Cl2FN2O10
Chemical Name:
Pregna-1,4-diene-3,20-dione,9-fluoro-11,17,21-trihydroxy-,(5Z,9alpha,11alpha,13E)
Synonyms:
(8S,9R,10S,11S,13S,14S,17R)-9-fluoro-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-one; Pregna-1,4-diene-3,20-dione,9-fluoro-11,17,21-trihydroxy-,(5Z,9alpha,11alpha,13E); 2,2-dichloro-N-[(1R,2R)-1,3-dihydroxy-1-(4-nitrophenyl)propan-2-yl]acetamide; Corti-fluoral;

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Pregna-1,4-diene-3,20-dione,9-fluoro-11,17,21-trihydroxy-,(5Z,9alpha,11alpha,13E) Basic Attributes

Molecular Weight：

701.56400

Exact Mass：

700.1965790 g/mol

Characteristics

PSA：

213.70000

XLogP3：

3.92220

Boiling Point：

566.7ºC

Flash Point：

296.5ºC

Vapor Pressure：

3.34E-15mmHg at 25°C

Drug Information

MeSH Entry Terms：

Corti-fluoral

Computed Properties

Molecular Weight:701.6
Hydrogen Bond Donor Count:6
Hydrogen Bond Acceptor Count:11
Rotatable Bond Count:7
Exact Mass:700.1965790
Monoisotopic Mass:700.1965790
Topological Polar Surface Area:210
Heavy Atom Count:47
Complexity:1120
Defined Atom Stereocenter Count:9
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes

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Guide of Pregna-1,4-diene-3,20-dione,9-fluoro-11,17,21-trihydroxy-,(5Z,9alpha,11alpha,13E)

Basic Attributes
Characteristics
Drug Information
Computed Properties

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