Basic information
- CAS
963-74-6- Standard SMILES
C[C@]12CCCC[C@@H]1CC[C@@H]1[C@@H]2CC[C@]2(C)C(=O)CC[C@@H]12- InChIKey
YJDYCULVYZDESB-HKQXQEGQSA-N- Molecular formula
- C19H30O
- Average molar mass
- 274.4 g/mol
- Monoisotopic mass
- 274.22966558
Names & identifiers
- Preferred name
- 5alpha-Androstan-17-one
- IUPAC
- (5R,8R,9S,10S,13S,14S)-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-17-one
- English name
- 5ALPHA-ANDROSTAN-17-ONE
- Molecular formula
- C19H30O
- Molecular weight
- 274.44
Names & synonyms
5alpha-Androstan-17-one963-74-65.alpha.-Androstan-17-oneRefChem:103501213-516-85-a-Androstan-17-one17-Oxo-5.alpha.-androstane(5R,8R,9S,10S,13S,14S)-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-17-oneCHEMBL205797617-Oxo-5a-androstaneAndrostan-17-one, (5.alpha.)-5-alpha-Androstan-17-one
Show more names
5A-ANDROSTANONEAndrostan-17-one5α-Androstan-17-one5-α-Androstan-17-oneANDROSTAN-17-ONE, 5A-17-Keto-5α-androstane5α(H)-Androstan-17-oneAndrostan-17-one, (5α)-
Androstan-17-one #(5alpha)-androstan-17-one17-Oxo-5alpha-androstaneAndrostan-17-one, (5alpha)-NSC90582EINECS 213-516-8NSC 905825a-androstan-17-one
Database identifiers
- CAS
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 427
Physicochemical properties
- Melting point
- 117 · 117 - 118°C
- storage temp.
- -20 °C · -20°C Freezer, Under inert atmosphere
- solubility
- Chloroform (Slightly), Methanol (Slightly)
- form
- Solid
- color
- White to Off-White
- CAS DataBase Reference
- 963 · 963-74-6
Chemistry & industry
Suppliers7 total
南京世洲生物科技有限公司025-85560043 15850508050 · [email protected]
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]
艾吉析科技（上海）有限公司17721401538;17717235263 17721401538 · [email protected]
陕西缔都医药化工有限公司029-029-81120477 17792793610 · [email protected]
上海策嵘生物科技有限公司（定制合成实验室）13062833949 · [email protected]
河南天孚化工有限公司+86-0371-55170693 +86-19937530512 · [email protected]
Related reactions
10 records
Compound notes
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