Methyl 3-cyanobicyclo[1.1.1]pentane-1-carboxylate

Base Information

Chemical Name:Methyl 3-cyanobicyclo[1.1.1]pentane-1-carboxylate
CAS No.:156329-62-3
Molecular Formula:C₈H₉NO₂
Molecular Weight:151.165
Hs Code.:2918300090
European Community (EC) Number:828-052-7
Mol file:156329-62-3.mol

Synonyms:Methyl 3-cyanobicyclo[1.1.1]pentane-1-carboxylate;156329-62-3;Bicyclo[1.1.1]pentane-1-carboxylic acid, 3-cyano-, methyl ester (9CI);SCHEMBL22276169;AMY34167;MFCD27664945;GS-8010;SB11720;CS-0039054;P14124;EN300-6214310;A883582;EN300-37374011;Methyl3-cyanobicyclo[1.1.1]pentane-1-carboxylate;Methyl 3-cyanobicyclo[1.1.1]pentane-1-carboxylate, AldrichCPR;Bicyclo[1.1.1]pentane-1-carboxylic acid, 3-cyano-, methyl ester

Suppliers and Price of Methyl 3-cyanobicyclo[1.1.1]pentane-1-carboxylate

Supply Marketing:

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

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

TRC
Methyl 3-cyanobicyclo[1.1.1]pentane-1-carboxylate
50mg
$ 110.00

Sigma-Aldrich
Methyl 3-cyanobicyclo[1.1.1]pentane-1-carboxylate AldrichCPR
100mg
$ 223.00

Matrix Scientific
Methyl 3-cyanobicyclo[1.1.1]pentane-1-carboxylate 97.0%
1g
$ 1582.00

Chemenu
Methyl 3-cyanobicyclo[1.1.1]pentane-1-carboxylate 97%
100mg
$ 216.00

Chemenu
Methyl 3-cyanobicyclo[1.1.1]pentane-1-carboxylate 97%
250mg
$ 330.00

Chemenu
Methyl 3-cyanobicyclo[1.1.1]pentane-1-carboxylate 97%
1g
$ 990.00

AK Scientific
Methyl 3-cyanobicyclo[1.1.1]pentane-1-carboxylate
1g
$ 1178.00

AK Scientific
Methyl 3-cyanobicyclo[1.1.1]pentane-1-carboxylate
250mg
$ 449.60

AK Scientific
Methyl 3-cyanobicyclo[1.1.1]pentane-1-carboxylate
10g
$ 5381.60

Activate Scientific
Methyl 3-cyanobicyclo[1.1.1]pentane-1-carboxylate 97+%
1 g
$ 1226.00

Total 25 raw suppliers

Chemical Property of Methyl 3-cyanobicyclo[1.1.1]pentane-1-carboxylate

Chemical Property:

PSA：50.09000
LogP:0.85328
Storage Temp.:Sealed in dry,Room Temperature
XLogP3:0.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:151.063328530
Heavy Atom Count:11
Complexity:253

Purity/Quality:

99%, ^*data from raw suppliers

Methyl 3-cyanobicyclo[1.1.1]pentane-1-carboxylate ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC(=O)C12CC(C1)(C2)C#N

Technology Process of Methyl 3-cyanobicyclo[1.1.1]pentane-1-carboxylate

There total 7 articles about Methyl 3-cyanobicyclo[1.1.1]pentane-1-carboxylate 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: 95.0%

: 156329-77-0
methyl 3-carbamoylbicyclo<1.1.1>pentane-1-carboxylate

: 156329-62-3
3-(hydroxymethyl)bicyclo[1.1.1]pentane-1-carbonitrile

Guidance literature:: With thionyl chloride; for 2h; Heating;
DOI:10.1021/jo00090a015

Reference yield:

: 83249-10-9
3‐(methoxycarbonyl)bicyclo[1.1.1]pentane‐1‐carboxylic acid

: 156329-62-3
3-(hydroxymethyl)bicyclo[1.1.1]pentane-1-carbonitrile

Guidance literature:: Multi-step reaction with 3 steps

1: C₂O₂Cl₂ / diethyl ether

2: NH₃ / CH₂Cl₂

3: 94 percent / SOCl₂

With thionyl chloride; oxalyl dichloride; ammonia; In diethyl ether; dichloromethane; 1: chlorination / 2: amination / 3: dehydration;
DOI:10.1016/S0968-0896(00)00270-4

Reference yield:

: 110371-22-7
methyl 3-(chlorocarbonyl)bicyclo<1.1.1>pentane-1-carboxylate

: 156329-62-3
3-(hydroxymethyl)bicyclo[1.1.1]pentane-1-carbonitrile

Guidance literature:: Multi-step reaction with 2 steps

1: NH₃ / CH₂Cl₂

2: 94 percent / SOCl₂

With thionyl chloride; ammonia; In dichloromethane; 1: amination / 2: dehydration;
DOI:10.1016/S0968-0896(00)00270-4