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Structure

Flurogestone acetate

CAS
2529-45-5
Catalog Number
ACM2529455
Category
Steroidal Compounds
Molecular Weight
406.49
Molecular Formula
C23H31FO5

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Specification

Synonyms
[(8S,9R,10S,11S,13S,14S,17R)-17-acetyl-9-fluoro-11-hydroxy-10,13-dimethyl-3-oxo-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl] acetate;
IUPAC Name
[(8S,9R,10S,11S,13S,14S,17R)-17-acetyl-9-fluoro-11-hydroxy-10,13-dimethyl-3-oxo-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl]acetate
Canonical SMILES
CC(=O)C1(CCC2C1(CC(C3(C2CCC4=CC(=O)CCC43C)F)O)C)OC(=O)C
InChI Key
JKQQZJHNUVDHKP-FQJIPJFPSA-N
Boiling Point
526.7ºC at 760mmHg
Melting Point
267.5ºC
Flash Point
272.3ºC
Density
1.24g/cm³
Appearance
COA
EC Number
219-776-9
Exact Mass
406.21600
What is the molecular formula of flurogestone acetate?

The molecular formula of flurogestone acetate is C23H31FO5.

What is the molecular weight of flurogestone acetate?

The molecular weight of flurogestone acetate is 406.5 g/mol.

What is the IUPAC name of flurogestone acetate?

The IUPAC name of flurogestone acetate is [(8S,9R,10S,11S,13S,14S,17R)-17-acetyl-9-fluoro-11-hydroxy-10,13-dimethyl-3-oxo-1,2,6,7,8,11,12,14,15,16-decahydrocyclopenta[a]phenanthren-17-yl] acetate.

What is the InChI of flurogestone acetate?

The InChI of flurogestone acetate is InChI=1S/C23H31FO5/c1-13(25)22(29-14(2)26)10-8-17-18-6-5-15-11-16(27)7-9-20(15,3)23(18,24)19(28)12-21(17,22)4/h11,17-19,28H,5-10,12H2,1-4H3/t17-,18-,19-,20-,21-,22-,23-/m0/s1.

What is the InChIKey of flurogestone acetate?

The InChIKey of flurogestone acetate is JKQQZJHNUVDHKP-FQJIPJFPSA-N.

What is the CAS number of flurogestone acetate?

The CAS number of flurogestone acetate is 2529-45-5.

What is the common name of flurogestone acetate?

The common name of flurogestone acetate is Flugestone acetate.

What is the ChEBI ID of flurogestone acetate?

The ChEBI ID of flurogestone acetate is CHEBI:2106773.

What is the XLogP3 value of flurogestone acetate?

The XLogP3 value of flurogestone acetate is 2.3.

What is the hydrogen bond donor count of flurogestone acetate?

The hydrogen bond donor count of flurogestone acetate is 1.

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