Androstane-3beta,11beta-diol-17-one

Base Information

Chemical Name:Androstane-3beta,11beta-diol-17-one
CAS No.:514-17-0
Molecular Formula:C19H30O3
Molecular Weight:306.445
Hs Code.:29144000
UNII:B6I75KUE58
DSSTox Substance ID:DTXSID101019310
Metabolomics Workbench ID:35314
Nikkaji Number:J36.147J
Wikidata:Q27274437
Mol file:514-17-0.mol

Synonyms:514-17-0;Androstane-3beta,11beta-diol-17-one;11-Hydroxyepiandrosterone;11beta-Hydroxyisoandrosterone;3beta,11beta-dihydroxy-androstan-17-one;B6I75KUE58;3,11-Dihydroxyandrostan-17-one;5alpha-Androstan-3beta,11beta-diol-17-one;UNII-B6I75KUE58;11beta-Hydroxyepiandrosterone;SCHEMBL4893508;11-HYDROXYISOANDROSTERONE;CHEBI:173049;DTXSID101019310;LMST02020004;11.BETA.-HYDROXYEPIANDROSTERONE;ANDROSTANE-3.BETA.,11.BETA.-DIOL-17-ONE;Q27274437;ANDROSTANE-3.BETA.,11.BETA.-DIOL-17-ONE [MI];ANDROSTAN-17-ONE, 3,11-DIHYDROXY-, (3.BETA.,5.ALPHA.,11.BETA.)-;(3S,5S,8S,9S,10S,11S,13S,14S)-3,11-dihydroxy-10,13-dimethyl-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-17-one

Suppliers and Price of Androstane-3beta,11beta-diol-17-one

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

American Custom Chemicals Corporation
5ALPHA-ANDROSTAN-3BETA,11BETA-DIOL-17-ONE 95.00%
5MG
$ 450.76

Total 4 raw suppliers

Chemical Property of Androstane-3beta,11beta-diol-17-one

Chemical Property:

Vapor Pressure:3.51E-10mmHg at 25°C
Melting Point:235-238°
Refractive Index:1.5560 (estimate)
Boiling Point:454.7°C at 760 mmHg
PKA:14.62±0.70(Predicted)
Flash Point:242.9°C
PSA：57.53000
Density:1.158g/cm³
LogP:2.92990
Water Solubility.:78.19mg/L(23.5 oC)
XLogP3:2.5
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:0
Exact Mass:306.21949481
Heavy Atom Count:22
Complexity:489

Purity/Quality:

98%min ^*data from raw suppliers

5ALPHA-ANDROSTAN-3BETA,11BETA-DIOL-17-ONE 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC12CCC(CC1CCC3C2C(CC4(C3CCC4=O)C)O)O
Isomeric SMILES:C[C@]12CC[C@@H](C[C@@H]1CC[C@@H]3[C@@H]2[C@H](C[C@]4([C@H]3CCC4=O)C)O)O

Technology Process of Androstane-3beta,11beta-diol-17-one

There total 27 articles about Androstane-3beta,11beta-diol-17-one which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

: 516-39-2
5α-pregnane-3β,11β,17,20β_F,21-pentaol

: 546-67-8
lead(IV) tetraacetate

: 64-19-7,77671-22-8
acetic acid

: 50-00-0,30525-89-4,61233-19-0
formaldehyd

: 514-17-0
3β,11β-dihydroxy-5α-androstan-17-one

Guidance literature:: at 50 ℃;
DOI:10.1002/hlca.19360190108

Reference yield:

: 57-61-4,514-17-0,739-26-4,2551-74-8,2618-30-6,3272-49-9,3461-66-3,4299-92-7,7013-18-5,7162-50-7,7801-12-9,25848-75-3,32212-55-8,91547-81-8,108739-34-0,116698-46-5
rac-3β,11β-dihydroxy-5α-androstan-17-one

Guidance literature:: With potassium tert-butylate; benzene; Erhitzen mit wss.Dioxan auf 220grad und Erwaermen mit wss.-methanol.NaOH;
DOI:10.1021/ja01605a016

Reference yield:

: 57-61-4,514-17-0,739-26-4,2551-74-8,2618-30-6,3272-49-9,3461-66-3,4299-92-7,7013-18-5,7162-50-7,7801-12-9,25848-75-3,32212-55-8,91547-81-8,108739-34-0,116698-46-5
rac-3β,11β-dihydroxy-5α,13α-androstane

Guidance literature:: With potassium tert-butylate; benzene; Erhitzen mit wss.Dioxan auf 220grad und Erwaermen mit wss.-methanol.NaOH;
DOI:10.1021/ja01605a016