(1S,4S,7aS)-1-Hydroxy-4,7a-dimethyl-4-phenylsulfanylmethyl-1,2,4,6,7,7a-hexahydro-inden-5-one

Base Information

• Chemical Name: (1S,4S,7aS)-1-Hydroxy-4,7a-dimethyl-4-phenylsulfanylmethyl-1,2,4,6,7,7a-hexahydro-inden-5-one
• CAS No.: 194931-05-0
• Molecular Formula: C₁₈H₂₂O₂S
• Molecular Weight: 302.437
• Mol file: 194931-05-0.mol

Synonyms:(1S,4S,7aS)-1-Hydroxy-4,7a-dimethyl-4-phenylsulfanylmethyl-1,2,4,6,7,7a-hexahydro-inden-5-one

Chemical Property of (1S,4S,7aS)-1-Hydroxy-4,7a-dimethyl-4-phenylsulfanylmethyl-1,2,4,6,7,7a-hexahydro-inden-5-one

Chemical Property:

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

Technology Process of (1S,4S,7aS)-1-Hydroxy-4,7a-dimethyl-4-phenylsulfanylmethyl-1,2,4,6,7,7a-hexahydro-inden-5-one

There total 4 articles about (1S,4S,7aS)-1-Hydroxy-4,7a-dimethyl-4-phenylsulfanylmethyl-1,2,4,6,7,7a-hexahydro-inden-5-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: 100.0%

(1S,4S,7aS)-4,7a-Dimethyl-4-phenylsulfanylmethyl-1-(tetrahydro-pyran-2-yloxy)-1,2,4,6,7,7a-hexahydro-inden-5-one (194931-04-9) → (1S,4S,7aS)-1-Hydroxy-4,7a-dimethyl-4-phenylsulfanylmethyl-1,2,4,6,7,7a-hexahydro-inden-5-one (194931-05-0)

Guidance literature:

With hydrogenchloride; In ethanol; for 16h; Ambient temperature;

DOI:10.1039/a703164e

Reference yield:

iodomethyl phenyl sulfide (51849-22-0) → (1S,4S,7aS)-1-Hydroxy-4,7a-dimethyl-4-phenylsulfanylmethyl-1,2,4,6,7,7a-hexahydro-inden-5-one (194931-05-0)

Guidance literature:

Multi-step reaction with 2 steps

1: KOBu-t / tetrahydrofuran / 1.) 0 deg C, 45 min, 2.) -78 deg C

2: 100 percent / HCl, H₂O / ethanol / 2 h / 25 °C

With hydrogenchloride; potassium tert-butylate; water; In tetrahydrofuran; ethanol;

DOI:10.1002/(SICI)1521-3765(19980807)4:8<1480::AID-CHEM1480>3.0.CO;2-6

Reference yield:

(1S,7aS)-4,7a-Dimethyl-1-(tetrahydro-pyran-2-yloxy)-1,2,3,6,7,7a-hexahydro-inden-5-one → (1S,4S,7aS)-1-Hydroxy-4,7a-dimethyl-4-phenylsulfanylmethyl-1,2,4,6,7,7a-hexahydro-inden-5-one (194931-05-0)

Guidance literature:

Multi-step reaction with 2 steps

1: 81 percent / KOBu-t / tetrahydrofuran / 1.) 0 deg C, 2.) -78 deg C, 30 min

2: 100 percent / HCl / ethanol / 16 h / Ambient temperature

With hydrogenchloride; potassium tert-butylate; In tetrahydrofuran; ethanol;

DOI:10.1039/a703164e

upstream raw materials:

(1S,4S,7aS)-4,7a-Dimethyl-4-phenylsulfanylmethyl-1-(tetrahydro-pyran-2-yloxy)-1,2,4,6,7,7a-hexahydro-inden-5-one

phenylthiomethyl chloride

iodomethyl phenyl sulfide

Downstream raw materials:

C₂₁H₃₀N₂O₃S

Acetic acid ((4R,7aR)-4,7a-dimethyl-5,6,7,7a-tetrahydro-4H-inden-4-yl)-phenylsulfanyl-methyl ester

(1S,4R,7aS)-4,7a-Dimethyl-4-phenylsulfanylmethyl-2,4,5,6,7,7a-hexahydro-1H-inden-1-ol