2-Butenoic acid, 4-(2-(((1,1-dimethylethyl)dimethylsilyl)oxy)cyclohexyl)-, methyl ester, (1alpha(E),2beta)-

Base Information

Chemical Name:2-Butenoic acid, 4-(2-(((1,1-dimethylethyl)dimethylsilyl)oxy)cyclohexyl)-, methyl ester, (1alpha(E),2beta)-
CAS No.:101976-92-5
Molecular Formula:C₁₇H₃₂O₃Si
Molecular Weight:312.525
Hs Code.:

Synonyms:101976-92-5;2-Butenoic acid, 4-(2-(((1,1-dimethylethyl)dimethylsilyl)oxy)cyclohexyl)-, methyl ester, (1alpha(E),2beta)-

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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 2-Butenoic acid, 4-(2-(((1,1-dimethylethyl)dimethylsilyl)oxy)cyclohexyl)-, methyl ester, (1alpha(E),2beta)-

Chemical Property:

Vapor Pressure:6.51E-05mmHg at 25°C
Boiling Point:344.6°Cat760mmHg
Flash Point:134.8°C
Density:0.94g/cm³
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:7
Exact Mass:312.21207141
Heavy Atom Count:21
Complexity:369

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)(C)[Si](C)(C)OC1CCCCC1CC=CC(=O)OC
Isomeric SMILES:CC(C)(C)[Si](C)(C)O[C@H]1CCCC[C@@H]1C/C=C/C(=O)OC

Technology Process of 2-Butenoic acid, 4-(2-(((1,1-dimethylethyl)dimethylsilyl)oxy)cyclohexyl)-, methyl ester, (1alpha(E),2beta)-

There total 4 articles about 2-Butenoic acid, 4-(2-(((1,1-dimethylethyl)dimethylsilyl)oxy)cyclohexyl)-, methyl ester, (1alpha(E),2beta)- 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: 86.0%

: 101859-27-2
(2-t-butyldimethylsiloxy)cyclohexylacetaldehyde

: 21204-67-1,2605-67-6
methyl (triphenylphosphoranylidene)acetate

: 101859-28-3,101976-92-5
(E)-4-[(1S,2R)-2-(tert-Butyl-dimethyl-silanyloxy)-cyclohexyl]-but-2-enoic acid methyl ester

Guidance literature:: In chloroform; Heating;
DOI:10.1021/jo00362a014

Reference yield:

: 74708-24-0,74708-25-1,90242-33-4,101976-91-4,74629-88-2
(1R*,2S*)-2-hydroxycyclohexane acetonitrile

: 101859-28-3,101976-92-5
(E)-4-[(1S,2R)-2-(tert-Butyl-dimethyl-silanyloxy)-cyclohexyl]-but-2-enoic acid methyl ester

Guidance literature:: Multi-step reaction with 3 steps

1: 88 percent / TEA, DMAP / tetrahydrofuran; dimethylformamide

2: 86 percent / dibal / toluene / -78 - 0 °C

3: 86 percent / CHCl₃ / Heating

With dmap; TEA; diisobutylaluminium hydride; In tetrahydrofuran; chloroform; N,N-dimethyl-formamide; toluene;
DOI:10.1021/jo00362a014

Reference yield:

: 286-20-4
cyclohexane-1,2-epoxide

: 101859-28-3,101976-92-5
(E)-4-[(1S,2R)-2-(tert-Butyl-dimethyl-silanyloxy)-cyclohexyl]-but-2-enoic acid methyl ester

Guidance literature:: Multi-step reaction with 4 steps

1: 78 percent / tetrahydrofuran / 0 °C

2: 88 percent / TEA, DMAP / tetrahydrofuran; dimethylformamide

3: 86 percent / dibal / toluene / -78 - 0 °C

4: 86 percent / CHCl₃ / Heating

With dmap; TEA; diisobutylaluminium hydride; In tetrahydrofuran; chloroform; N,N-dimethyl-formamide; toluene;
DOI:10.1021/jo00362a014