Basic information
- CAS
2838-94-0- Standard SMILES
C[C@]12CCC(=O)C=C1CC[C@@H]1[C@@H]2CC[C@]2(C)C(=O)[C@@H](F)C[C@@H]12- InChIKey
WVGGMHNJNOYSMF-HKQXQEGQSA-N- Molecular formula
- C19H25FO2
- Average molar mass
- 304.4 g/mol
- Monoisotopic mass
- 304.1838582
Overview
16beta-Fluoroandrost-4-ene-3,17-dione is a 3-hydroxy steroid. It has a role as an androgen.
Names & identifiers
- Preferred name
- Androst-4-ene-3,17-dione, 16beta-fluoro-
- IUPAC
- (8R,9S,10R,13S,14S,16S)-16-fluoro-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-3,17-dione
- English name
- (8R,9S,10R,13S,14S,16S)-16-fluoro-10,13-dimethyl-2,6,7,8,9,11,12,14,15 ,16-decahydro-1H-cyclopenta[a]phenanthrene-3,17-dione
- Molecular formula
- C19H25FO2
- Molecular weight
- 304.4
Names & synonyms
2838-94-0Androst-4-ene-3,17-dione, 16beta-fluoro-UNII-2SRF28Q1ST2SRF28Q1ST16beta-Fluoroandrost-4-ene-3,17-dioneNSC 56951NSC-56951CHEBI:79413DTXSID60182614NSC56951(8R,9S,10R,13S,14S,16S)-16-fluoro-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene-3,17-dione16beta-fluoro-androst-4-ene-3,17-dione
Show more names
Androst-4-ene-3,17-dione, 16β-fluoro- (6CI,8CI)
Q27148455ANDROST-4-ENE-3,17-DIONE, 16.BETA.-FLUORO-(8R,9S,10R,13S,14S,16S)-16-fluoro-10,13-dimethyl-2,6,7,8,9,11,12,14,15 ,16-decahydro-1H-cyclopenta[a]phenanthrene-3,17-dione
Database identifiers
- CAS
2838-94-0- PubChem CID
- 245232
- DTXSID
DTXSID60182614- ChEBI
CHEBI:79413- UNII
- 2SRF28Q1ST
- Nikkaji
- J2.790.328B
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 34.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 580
Physicochemical properties
- Melting point
- 171 · 171-174 °C
- Boiling point
- 430.2 · 430.2±45.0 °C(Predicted)
- Density
- 1.16 · 1.16±0.1 g/cm3(Predicted)
- FDA UNII
- 2 SRF28Q1ST · 2SRF28Q1ST
Chemistry & industry
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Additional notes
DefinitionChEBI: 16beta-Fluoroandrost-4-ene-3,17-dione is a 3-hydroxy steroid. It has a role as an androgen.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…