2-Methyl-3-hexyn-2-ol

Base Information

Chemical Name:2-Methyl-3-hexyn-2-ol
CAS No.:5075-33-2
Molecular Formula:C7H12O
Molecular Weight:112.17
Hs Code.:2905290000
European Community (EC) Number:623-008-1
DSSTox Substance ID:DTXSID20398956
Nikkaji Number:J2.112.406K
Wikidata:Q82201222
Mol file:5075-33-2.mol

Synonyms:2-Methyl-3-hexyn-2-ol;2-methylhex-3-yn-2-ol;5075-33-2;2-methyl-hex-3-yn-2-ol;2-methyl-3-hexyne-2-ol;SCHEMBL252969;DTXSID20398956;2-Methyl-3-hexyn-2-ol, 97%;CS-0243327;FT-0635533;EN300-262414

Suppliers and Price of 2-Methyl-3-hexyn-2-ol

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
2-methylhex-3-yn-2-ol
10mg
$ 45.00

GFS CHEMICALS
2-METHYL-3-HEXYN-2-OL,98%
10 G
$ 1055.76

American Custom Chemicals Corporation
2-METHYL-3-HEXYN-2-OL 95.00%
25G
$ 1685.72

AHH
2-Methyl-3-hexyn-2-ol 97%
25g
$ 490.00

Total 4 raw suppliers

Chemical Property of 2-Methyl-3-hexyn-2-ol

Chemical Property:

Vapor Pressure:1.86mmHg at 25°C
Melting Point:-6°C
Refractive Index:n20/D 1.44(lit.)
Boiling Point:144 °C(lit.)
PKA:13.18±0.29(Predicted)
Flash Point:117 °F
PSA：20.23000
Density:0.856 g/mL at 25 °C(lit.)
LogP:1.17070
XLogP3:1.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:1
Exact Mass:112.088815002
Heavy Atom Count:8
Complexity:122

Purity/Quality:

99% ^*data from raw suppliers

2-methylhex-3-yn-2-ol ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:Xi
Statements: 36/37/38
Safety Statements: 26-36

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCC#CC(C)(C)O

Technology Process of 2-Methyl-3-hexyn-2-ol

There total 8 articles about 2-Methyl-3-hexyn-2-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: 84.0%

: 74-96-4
ethyl bromide

: 115-19-5
2-methyl-but-3-yn-2-ol

: 5075-33-2
2-methyl-3-hexyn-2-ol

Guidance literature:: With lithium amide; In diethyl ether; at -40 ℃;

Reference yield:

: 690-94-8
dimethyl(vinylethynyl)carbinol

: 16744-89-1
2-methylhex-5-en-2-ol

: 5075-33-2
2-methyl-3-hexyn-2-ol

Guidance literature:: Hydrogenation;

Reference yield:

: 107-00-6
but-1-yne

: 67-64-1
acetone

: 5075-33-2
2-methyl-3-hexyn-2-ol

Guidance literature:: but-1-yne; With n-butyllithium; In toluene; at -20 ℃; for 0.5h; Inert atmosphere;

acetone; In toluene; at -78 - 20 ℃;
DOI:10.1021/acs.orglett.5b00671