3,4-Dimethyl-1-pentyn-3-ol

Base Information

Chemical Name:3,4-Dimethyl-1-pentyn-3-ol
CAS No.:1482-15-1
Molecular Formula:C7H12 O
Molecular Weight:112.172
Hs Code.:2905290000
European Community (EC) Number:679-727-6
NSC Number:14253
UNII:4HME360EIQ
DSSTox Substance ID:DTXSID9022154
Nikkaji Number:J99.888E
Wikidata:Q27259601
Mol file:1482-15-1.mol

Synonyms:3,4-Dimethyl-1-pentyn-3-ol;1482-15-1;3,4-dimethylpent-1-yn-3-ol;1-Pentyn-3-ol, 3,4-dimethyl-;4HME360EIQ;NSC-14253;(1,2-Dimethyl-1-hydroxypropyl)acetylene;UNII-4HME360EIQ;3,4-dimethyl-pent-1-yn-3-ol;NSC14253;1-Pentyn-3-ol,4-dimethyl-;SCHEMBL236180;DTXSID9022154;DZNLEQBXXLGELU-UHFFFAOYSA-;Ethynyl isopropyl methyl carbinol;MFCD00039845;NSC 14253;AKOS006229568;2,3-DIMETHYL-4-PENTYN-3-OL;AS-77005;(1,2-Dimethyl)-1-hydroxypropyl)acetylene;3,4-Dimethyl-1-pentyn-3-ol, AldrichCPR;D1276;FT-0633590;T70305;3,4-DIMETHYL-1-PENTYN-3-OL, (+/-)-;J-008451;Q27259601;InChI=1/C7H12O/c1-5-7(4,8)6(2)3/h1,6,8H,2-4H3

Suppliers and Price of 3,4-Dimethyl-1-pentyn-3-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
3,4-Dimethyl-1-pentyn-3-ol
1g
$ 130.00

TCI Chemical
3,4-Dimethyl-1-pentyn-3-ol >96.0%(GC)
10mL
$ 336.00

Alfa Aesar
3,4-Dimethyl-1-pentyn-3-ol, 94%
25g
$ 121.00

Alfa Aesar
3,4-Dimethyl-1-pentyn-3-ol, 94%
5g
$ 32.10

AK Scientific
3,4-Dimethyl-1-pentyn-3-ol
10ml
$ 499.00

AHH
3,4-Dimethyl-1-pentyn-3-ol 94%
100g
$ 708.00

Total 19 raw suppliers

Chemical Property of 3,4-Dimethyl-1-pentyn-3-ol

Chemical Property:

Vapor Pressure:3.19mmHg at 25°C
Melting Point:-20.62°C (estimate)
Refractive Index:1.4360-1.4380
Boiling Point:136.2°Cat760mmHg
PKA:13.21±0.29(Predicted)
Flash Point:37.2°C
PSA：20.23000
Density:0.891g/cm³
LogP:1.02660
Water Solubility.:Fully miscible in water.
XLogP3:1.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:2
Exact Mass:112.088815002
Heavy Atom Count:8
Complexity:118

Purity/Quality:

98%,99%, ^*data from raw suppliers

3,4-Dimethyl-1-pentyn-3-ol ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xn
Hazard Codes:Xn
Statements: 10-22
Safety Statements: 16

MSDS Files:: SDS file from LookChem

Useful:

Chemical Classes:Other Classes -> Alcohols and Polyols, Other
Canonical SMILES:CC(C)C(C)(C#C)O
Uses 3,4-Dimethyl-1-pentyn-3-ol is used as pharmaceutical intermediates.

Technology Process of 3,4-Dimethyl-1-pentyn-3-ol

There total 9 articles about 3,4-Dimethyl-1-pentyn-3-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: 45.0%