(6alpha)-17-(Acetyloxy)-6-chloropregn-4-ene-3,20-dione
Basic information
- CAS
2477-73-8- Standard SMILES
CC(=O)O[C@]1(C(C)=O)CC[C@H]2[C@@H]3C[C@H](Cl)C4=CC(=O)CC[C@]4(C)[C@H]3CC[C@@]21C- InChIKey
DCVGANSDLNPXGO-WXLIAARGSA-N- Molecular formula
- C23H31ClO4
- Average molar mass
- 406.9 g/mol
- Monoisotopic mass
- 406.1910872
Overview
6alpha-Chloro-17-acetoxyprogesterone is a corticosteroid hormone.
Names & identifiers
- Preferred name
- (6alpha)-17-(Acetyloxy)-6-chloropregn-4-ene-3,20-dione
- IUPAC
- [(6S,8R,9S,10R,13S,14S,17R)-17-acetyl-6-chloro-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl] acetate
- English name
- 6α-Chloro-17-acetoxy Progesterone
- Molecular formula
- C23H31ClO4
- Molecular weight
- 406.94
Names & synonyms
Hydromadinone acetate2477-73-8X8WV0125VZNSC-33170Progesterone, 6alpha-chloro-17-hydroxy-, acetate6-alpha-Chloro-17-hydroxypregn-4-ene-3,20-dione acetateDTXSID901226145RS-1103(6alpha)-17-(Acetyloxy)-6-chloropregn-4-ene-3,20-dionePregn-4-ene-3,20-dione, 6alpha-chloro-17-hydroxy-, acetatePregn-4-ene-3,20-dione, 17-(acetyloxy)-6-chloro-, (6alpha)-RefChem:405121
Show more names
NSC 33170Progesterone Impurity 17Chlormadinone Acetate EP Imp A6a-chloro-17-acetoxyprogesteroneChlormadinone acetate Impurity 16α-Chloro-17-acetoxy ProgesteroneChlormadinone Acetate EP Impurity A6α-Chloro-17-hydroxyprogesterone Acetate17-Acetoxy-9a-chloropregan-4-ene-3,20-dione
DTXCID801657399pregn-4-ene-3,20-dione, 17-(acetyloxy)-6-chloro-, (6 alpha)-806-599-26-Chloro-17-acetoxyprogesterone6alpha-Chloro-17-acetoxyprogesterone6alpha-Chloro-17-acetoxy progesterone6a-Chloro-17-acetoxy ProgesteroneRS 1103
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 60.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 773
Experimental & physicochemical properties
Endocrine DisruptorsPotential endocrine disrupting compound
Physicochemical properties
- Melting point
- 192 °C · 192 °C
- Boiling point
- 519.3 · 519.3±50.0 °C(Predicted)
- Density
- 1.21 · 1.21±0.1 g/cm3(Predicted)
- storage temp.
- -20 °C · Amber Vial, -20°C Freezer
- solubility
- Chloroform (Slightly), Ethyl Acetate (Slightly), Methanol (Slightly)
- form
- Solid
- color
- White to Pale Yellow
- Stability
- Light Sensitive
- FDA UNII
- 8 WV0125VZ · X8WV0125VZ
- Symbol(GHS)
- 8 · GHS08
- Signal word
- Warning
- Hazard statements
- 361 · H361-H351
- Precautionary statements
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H351 (100%): Suspected of causing cancer [Warning Carcinogenicity]
P203, P280, P318, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesCarc. 2 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS08
- Hazard statements
- H361-H351
- Precautionary statements
- P201-P202-P281-P308+P313-P405-P501-P201-P202-P281-P308+P313-P405-P501
Chemistry & industry
Applications
UsesProgesterone (P755900) impurity.
Upstream & downstream products
Upstream raw materials
Additional notes
DefinitionChEBI: 6alpha-Chloro-17-acetoxyprogesterone is a corticosteroid hormone.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…