[(8R,9S,13S,14S,17S)-17-(1-methoxycyclohexyl)oxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl] benzoate

Base Information

Chemical Name:[(8R,9S,13S,14S,17S)-17-(1-methoxycyclohexyl)oxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl] benzoate
CAS No.:41623-20-5
Molecular Formula:C₃₂H₄₀O₄
Molecular Weight:488.667
Hs Code.:
NSC Number:73874
Mol file:41623-20-5.mol

[(8R,9S,13S,14S,17S)-17-(1-methoxycyclohexyl)oxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl] benzoate

Synonyms:NSC73874;NSC-73874;41623-20-5

Suppliers and Price of [(8R,9S,13S,14S,17S)-17-(1-methoxycyclohexyl)oxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl] benzoate

Supply Marketing:

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

Manufacturers and distributors:

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Total 3 raw suppliers

Chemical Property of [(8R,9S,13S,14S,17S)-17-(1-methoxycyclohexyl)oxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl] benzoate

Chemical Property:

Vapor Pressure:5.95E-14mmHg at 25°C
Boiling Point:591.2°Cat760mmHg
Flash Point:248.6°C
Density:1.17g/cm³
XLogP3:6.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:488.29265975
Heavy Atom Count:36
Complexity:768

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC12CCC3C(C1CCC2OC4(CCCCC4)OC)CCC5=C3C=CC(=C5)OC(=O)C6=CC=CC=C6
Isomeric SMILES:C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2OC4(CCCCC4)OC)CCC5=C3C=CC(=C5)OC(=O)C6=CC=CC=C6

Technology Process of [(8R,9S,13S,14S,17S)-17-(1-methoxycyclohexyl)oxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl] benzoate

There total 1 articles about [(8R,9S,13S,14S,17S)-17-(1-methoxycyclohexyl)oxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl] benzoate 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:

: 931-57-7
1-methoxy-cyclohex-1-ene

: 50-50-0
Estradiol 3-benzoate

: 41623-20-5
Benzoic acid (8R,9S,13S,14S,17S)-17-(1-methoxy-cyclohexyloxy)-13-methyl-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthren-3-yl ester

Guidance literature:: With pyridine; toluene-4-sulfonic acid; In tert-butyl alcohol;
DOI:10.1021/jm00260a009

Reference yield:

: 41623-20-5
Benzoic acid (8R,9S,13S,14S,17S)-17-(1-methoxy-cyclohexyloxy)-13-methyl-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthren-3-yl ester

: 13885-27-3
(8R,9S,13S,14S,17S)-17-(1-Methoxy-cyclohexyloxy)-13-methyl-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthren-3-ol

Guidance literature:: With potassium carbonate; In methanol; Heating;
DOI:10.1021/jm00260a009

Reference yield:

: 41623-20-5
Benzoic acid (8R,9S,13S,14S,17S)-17-(1-methoxy-cyclohexyloxy)-13-methyl-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthren-3-yl ester

: Propionic acid (8R,9S,13S,14S,17S)-17-(1-methoxy-cyclohexyloxy)-13-methyl-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthren-3-yl ester

Guidance literature:: Multi-step reaction with 2 steps

1: aq. K₂CO₃ / methanol / Heating

2: Py

With pyridine; potassium carbonate; In methanol;
DOI:10.1021/jm00260a009