1-Methylcyclohex-3-ene-1-carboxylic acid

Base Information

Chemical Name:1-Methylcyclohex-3-ene-1-carboxylic acid
CAS No.:16646-42-7
Molecular Formula:C8H12 O2
Molecular Weight:140.182
Hs Code.:2916209090
DSSTox Substance ID:DTXSID90937199
Nikkaji Number:J34.013H
Mol file:16646-42-7.mol

Synonyms:16646-42-7;1-methylcyclohex-3-ene-1-carboxylic acid;1-Methyl-3-cyclohexenecarboxylic acid;1-methylcyclohex-3-enecarboxylic acid;1-Methyl-3-cyclohexene-1-carboxylic acid;3-Cyclohexene-1-carboxylic acid, 1-methyl-;BRN 0637136;1-Methyl-cyclohex-3-enecarboxylic acid;3-09-00-00163 (Beilstein Handbook Reference);SCHEMBL91179;DTXSID90937199;MFCD01735194;AKOS006276833;AS-65519;LS-57444;1-METHYL-3-CYCLOHEXENECARBOXYLICACID;CS-0037307;EN300-247185;W11357;A1-01320;Z1198158411

Suppliers and Price of 1-Methylcyclohex-3-ene-1-carboxylic acid

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

Crysdot
1-Methylcyclohex-3-enecarboxylicacid 97%
5g
$ 1563.00

Crysdot
1-Methylcyclohex-3-enecarboxylicacid 97%
1g
$ 520.00

American Custom Chemicals Corporation
1-METHYL-3-CYCLOHEXENECARBOXYLIC ACID 95.00%
5MG
$ 503.81

AK Scientific
1-methylcyclohex-3-ene-1-carboxylicacid
25g
$ 3707.60

AK Scientific
1-methylcyclohex-3-ene-1-carboxylicacid
5g
$ 1421.60

A1 Biochem Labs
1-Methyl-cyclohex-3-enecarboxylicacid 95%
10 g
$ 950.00

Total 5 raw suppliers

Chemical Property of 1-Methylcyclohex-3-ene-1-carboxylic acid

Chemical Property:

Vapor Pressure:0.014mmHg at 25°C
Melting Point:78-79 °C
Boiling Point:238.9°Cat760mmHg
PKA:4.79±0.20(Predicted)
Flash Point:111.2°C
PSA：37.30000
Density:1.074g/cm³
LogP:1.81740
XLogP3:1.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:140.083729621
Heavy Atom Count:10
Complexity:172

Purity/Quality:

98% ^*data from raw suppliers

1-Methylcyclohex-3-enecarboxylicacid 97% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1(CCC=CC1)C(=O)O

Technology Process of 1-Methylcyclohex-3-ene-1-carboxylic acid

There total 14 articles about 1-Methylcyclohex-3-ene-1-carboxylic acid 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: 97.0%

: 4771-80-6
1,2,5,6-tetrahydrobenzoic acid

: 74-88-4
methyl iodide

: 16646-42-7
1-methyl-3-cyclohexenecarboxylic acid

Guidance literature:: 1,2,5,6-tetrahydrobenzoic acid; With n-butyllithium; bis(dimethylamino)(i-propyl)phosphine oxide; diisopropylamine; In tetrahydrofuran; hexane; at -20 - 20 ℃; Inert atmosphere;

methyl iodide; In tetrahydrofuran; hexane; at -25 - 20 ℃;
DOI:10.1021/ja1017877