Basic information
- CAS
1164-95-0- Standard SMILES
CC(=O)O[C@@H]1CC[C@@]2(C)[C@@H](CC[C@@H]3[C@@H]2CC[C@]2(C)C(=O)CC[C@@H]32)C1- InChIKey
FDCINQSOYQUNKB-XVYLQWLCSA-N- Molecular formula
- C21H32O3
- Average molar mass
- 332.5 g/mol
- Monoisotopic mass
- 332.23514488
Names & identifiers
- Preferred name
- Androsterone acetate
- IUPAC
- [(3R,5S,8R,9S,10S,13S,14S)-10,13-dimethyl-17-oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl] acetate
- English name
- ANDROSTERONE ACETATE
- Molecular formula
- C21H32O3
- Molecular weight
- 332.48
Names & synonyms
Androsterone acetateEINECS 214-612-2RefChem:558051214-612-21164-95-0[(3R,5S,8R,9S,10S,13S,14S)-10,13-dimethyl-17-oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl] acetateCHEMBL2074705[(3R,5S,10S,13S)-10,13-dimethyl-17-oxo-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl] acetateAndrosterone 3-acetate17-Oxoandrostan-3-yl acetate17-Oxoandrostan-3-yl acetate #SCHEMBL604251
Show more names
acetylandrosteroneandrosterone acetate crystalline5α-ANDROSTAN-3α-OL-17-ONE ACETATE3α-(Acetyloxy)-5α-androstan-17-oneANDROSTERONE 3-ACETATE VETRANAL, 100 MG3α-Hydroxy-5α-Androstan-17-One 3-Acetate
DTXSID50922041BDBM50420243AKOS0159165023alpha-acetoxy-5alpha-androstan-17-one17-Oxo-5alpha-androstan-3alpha-yl acetateNS00045984(3R,5S,8R,9S,10S,13S,14S)-10,13-dimethyl-17-oxohexadecahydro-1H-cyclopenta[a]phenanthren-3-yl acetateAcetic acid (3R,5S,8R,10S,13S)-10,13-dimethyl-17-oxo-hexadecahydro-cyclopenta[a]phenanthren-3-yl ester
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 43.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 555
Physicochemical properties
- Melting point
- 102 · 102-106 °C(Solv: ethyl ether (60-29-7); pentane (109-66-0))
- Boiling point
- 424.6 · 424.6±45.0 °C(Predicted)
- Density
- 1.09 · 1.09±0.1 g/cm3(Predicted)
- Symbol(GHS)
- 8 · GHS08
- Signal word
- Warning
- Hazard statements
- 351 · H351
- Precautionary statements
- 201 · P201-P202-P281-P308+P313-P405-P501
- Hazard Codes
- Xn
- Risk Statements
- 40 · 40-48
- Safety Statements
- 22 · 22-24/25-36/37
Safety & regulation
GHS classification
GHS Classification
Warning
H351 (97.4%): Suspected of causing cancer [Warning Carcinogenicity]
P203, P280, P318, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory.；Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Hazard information
Hazard Classes and CategoriesCarc. 2 (97.4%)
Safety data
- risk_code
- 40-48
- Signal word
- Warning
- Symbol(GHS)
- GHS08
- hazard_code
- Xn
- safety_code
- 22-24/25-36/37
- Hazard statements
- H351
- Precautionary statements
- P201-P202-P281-P308+P313-P405-P501
Chemistry & industry
Applications
Usesandrogen
Upstream & downstream products
Downstream products
Suppliers9 total
上海赛可锐生物科技有限公司021-58000709 13120558703 · [email protected]
上海维亦特生物科技有限公司15317051735 · [email protected]
湖北扬信医药科技有限公司15347293736 · [email protected]
上海陶素生化科技有限公司021-33632979 · [email protected]
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
山东小野化学股份有限公司0539-6362799 20）
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
上海甄准生物科技有限公司18019219489 18901678489 · [email protected]
Shaanxi Dideu Medichem Co. Ltd+86-17392712779 · [email protected]
Related reactions
2 records
Compound notes
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