5,5-Dimethyl-2-[(phenylsulfanyl)methyl]cyclohex-2-en-1-ol

Base Information

Chemical Name:5,5-Dimethyl-2-[(phenylsulfanyl)methyl]cyclohex-2-en-1-ol
CAS No.:139294-23-8
Molecular Formula:C₁₅H₂₀OS
Molecular Weight:248.389
Hs Code.:
DSSTox Substance ID:DTXSID10566501

Synonyms:139294-23-8;DTXSID10566501;5,5-Dimethyl-2-[(phenylsulfanyl)methyl]cyclohex-2-en-1-ol

Suppliers and Price of 5,5-Dimethyl-2-[(phenylsulfanyl)methyl]cyclohex-2-en-1-ol

Supply Marketing:

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

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Chemical Property of 5,5-Dimethyl-2-[(phenylsulfanyl)methyl]cyclohex-2-en-1-ol

Chemical Property:

PSA：45.53000
LogP:3.88600
XLogP3:3.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:248.12348643
Heavy Atom Count:17
Complexity:277

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1(CC=C(C(C1)O)CSC2=CC=CC=C2)C

Technology Process of 5,5-Dimethyl-2-[(phenylsulfanyl)methyl]cyclohex-2-en-1-ol

There total 3 articles about 5,5-Dimethyl-2-[(phenylsulfanyl)methyl]cyclohex-2-en-1-ol 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:

: 5,5-Dimethyl-2-phenylsulfanylmethyl-cyclohex-2-enone

: 139294-23-8
5,5-Dimethyl-2-phenylsulfanylmethyl-cyclohex-2-enol

Guidance literature:: With sodium tetrahydroborate; cerium(III) chloride; In methanol; Yield given;
DOI:10.1016/0040-4039(91)80778-5

Reference yield:

: 4694-17-1
5,5-dimethlycyclohex-2-en-1-one

: 139294-23-8
5,5-Dimethyl-2-phenylsulfanylmethyl-cyclohex-2-enol

Guidance literature:: Multi-step reaction with 2 steps

1: NEt₃ / H₂O; ethanol

2: NaBH₄, CeCl₃ / methanol

With sodium tetrahydroborate; cerium(III) chloride; triethylamine; In methanol; ethanol; water;
DOI:10.1016/0040-4039(91)80778-5

Reference yield:

: 108-98-5
thiophenol

: 139294-23-8
5,5-Dimethyl-2-phenylsulfanylmethyl-cyclohex-2-enol

Guidance literature:: Multi-step reaction with 2 steps

1: NEt₃ / H₂O; ethanol

2: NaBH₄, CeCl₃ / methanol

With sodium tetrahydroborate; cerium(III) chloride; triethylamine; In methanol; ethanol; water;
DOI:10.1016/0040-4039(91)80778-5