2,2-Dimethyl-3-octanol

Base Information

Chemical Name:2,2-Dimethyl-3-octanol
CAS No.:19841-72-6
Molecular Formula:C10H22 O
Molecular Weight:158.284
Hs Code.:2905199090
NSC Number:97551
Nikkaji Number:J2.344.034B
Mol file:19841-72-6.mol

Synonyms:2,2-Dimethyl-3-octanol;19841-72-6;2,2-dimethyloctan-3-ol;3-Octanol, 2,2-dimethyl-;NSC97551;3-Octanol,2-dimethyl-;SCHEMBL2395540;AZIWNYAWODSERA-UHFFFAOYSA-N;MFCD00021945;NSC 97551;NSC-97551;AKOS009158799

Suppliers and Price of 2,2-Dimethyl-3-octanol

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
2,2-Dimethyl-3-octanol
50mg
$ 45.00

Sigma-Aldrich
2,2-DIMETHYL-3-OCTANOL Aldrich
1g
$ 33.40

Alfa Aesar
2,2-Dimethyl-3-octanol, 98%
25g
$ 200.00

Alfa Aesar
2,2-Dimethyl-3-octanol, 98%
5g
$ 56.30

Alfa Aesar
2,2-Dimethyl-3-octanol, 98%
1g
$ 16.10

Total 9 raw suppliers

Chemical Property of 2,2-Dimethyl-3-octanol

Chemical Property:

Vapor Pressure:0.115mmHg at 25°C
Melting Point:-1.53°C (estimate)
Refractive Index:1.4320
Boiling Point:194.5°Cat760mmHg
PKA:15.44±0.20(Predicted)
Flash Point:82.5°C
PSA：20.23000
Density:0.826g/cm³
LogP:2.97370
XLogP3:3.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:5
Exact Mass:158.167065321
Heavy Atom Count:11
Complexity:91.5

Purity/Quality:

99% ^*data from raw suppliers

2,2-Dimethyl-3-octanol ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:
Statements: 36/37/38
Safety Statements: 26-37/39

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

Canonical SMILES:CCCCCC(C(C)(C)C)O

Technology Process of 2,2-Dimethyl-3-octanol

There total 7 articles about 2,2-Dimethyl-3-octanol 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: 91.0%

: 594-19-4
tert.-butyl lithium

: 66-25-1
hexanal

: 19841-72-6
2,2-dimethoxy-3-octanol

Guidance literature:: In diethyl ether; pentane; 1.) -78 deg C, 1 h, 2.) room temp., 2.5 h;
DOI:10.1021/jo00171a035

Reference yield: 62.0%

: 111-13-7
hexyl-methyl-ketone

: 75-25-2
Bromoform

: 19841-72-6
2,2-dimethoxy-3-octanol

: 106-73-0
methyl heptanoate

: 149-73-5
trimethyl orthoformate

Guidance literature:: With methanol; sodium bromide; at 30 ℃; electrolysis (Pt-anode, Cu-Zn (60:40)-cathode, 220 mA/cm² constant current density);
DOI:10.1016/S0040-4020(01)87078-2