(3aS,3bR,5aR,9aR,9bS,11aS)-1-iodo-9a,11a-dimethyl-3,3a,3b,4,5,5a,6,8,9,9b,10,11-dodecahydroindeno[5,4-f]quinolin-7-one

Base Information

Chemical Name:(3aS,3bR,5aR,9aR,9bS,11aS)-1-iodo-9a,11a-dimethyl-3,3a,3b,4,5,5a,6,8,9,9b,10,11-dodecahydroindeno[5,4-f]quinolin-7-one
CAS No.:158136-71-1
Molecular Formula:C₁₈H₂₆INO
Molecular Weight:399.315
Hs Code.:
European Community (EC) Number:605-133-3
DSSTox Substance ID:DTXSID801102532
Nikkaji Number:J1.155.340K

Synonyms:SCHEMBL7527038;DTXSID801102532;158136-71-1;(4aR,4bS,6aS,9aS,9bR,11aR)-1,3,4,4a,4b,5,6,6a,9,9a,9b,10,11,11a-Tetradecahydro-7-iodo-4a,6a-dimethyl-2H-indeno[5,4-f]quinolin-2-one

Suppliers and Price of (3aS,3bR,5aR,9aR,9bS,11aS)-1-iodo-9a,11a-dimethyl-3,3a,3b,4,5,5a,6,8,9,9b,10,11-dodecahydroindeno[5,4-f]quinolin-7-one

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

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Chemical Property of (3aS,3bR,5aR,9aR,9bS,11aS)-1-iodo-9a,11a-dimethyl-3,3a,3b,4,5,5a,6,8,9,9b,10,11-dodecahydroindeno[5,4-f]quinolin-7-one

Chemical Property:

Vapor Pressure:1.56E-09mmHg at 25°C
XLogP3:4.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:0
Exact Mass:399.10591
Heavy Atom Count:21
Complexity:515

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC12CCC(=O)NC1CCC3C2CCC4(C3CC=C4I)C
Isomeric SMILES:C[C@]12CCC(=O)N[C@@H]1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC=C4I)C

Technology Process of (3aS,3bR,5aR,9aR,9bS,11aS)-1-iodo-9a,11a-dimethyl-3,3a,3b,4,5,5a,6,8,9,9b,10,11-dodecahydroindeno[5,4-f]quinolin-7-one

There total 2 articles about (3aS,3bR,5aR,9aR,9bS,11aS)-1-iodo-9a,11a-dimethyl-3,3a,3b,4,5,5a,6,8,9,9b,10,11-dodecahydroindeno[5,4-f]quinolin-7-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: 65.0%

: 158136-71-1
17-iodo-4-aza-5α-androsta-16-en-3-one

Guidance literature:

Reference yield:

: 158136-68-6
17-hydrazono-4-aza-5α-androstan-3-one

: 158136-71-1
17-iodo-4-aza-5α-androsta-16-en-3-one

Guidance literature:: With iodine; triethylamine; In chloroform; benzene;

Reference yield:

: 201230-82-2
carbon monoxide

: 530-47-2,29666-92-0
N,N-diphenylhydrazine hydrochloride

: 158136-71-1
17-iodo-4-aza-5α-androsta-16-en-3-one

: (4aR,4bS,6aS,9aS,9bS,11aR)-4a,6a-Dimethyl-2-oxo-2,3,4,4a,4b,5,6,6a,9,9a,9b,10,11,11a-tetradecahydro-1H-indeno[5,4-f]quinoline-7-carboxylic acid N',N'-diphenyl-hydrazide

Guidance literature:: With triethylamine; palladium diacetate; In N,N-dimethyl-formamide; at 60 ℃; Yield given;
DOI:10.1016/S0040-4039(97)00903-9