2-Tert-butylpropane-1,3-diol

Base Information

Chemical Name:2-Tert-butylpropane-1,3-diol
CAS No.:2819-05-8
Molecular Formula:C7H16 O2
Molecular Weight:132.203
Hs Code.:2905399090
NSC Number:268916
DSSTox Substance ID:DTXSID80182459
Nikkaji Number:J1.343.955I
Wikidata:Q83053150
Mol file:2819-05-8.mol

Synonyms:2-tert-butylpropane-1,3-diol;2819-05-8;2-(tert-butyl)propane-1,3-diol;2-tert-Butyl-1,3-propanediol;1,3-Propanediol, 2-tert-butyl-;1,3-Propanediol, 2-(1,1-dimethylethyl)-;BRN 1900687;NSC268916;2-t-butylpropane-1,3-diol;SCHEMBL2300144;2-tert.-butylpropane-1,3-diol;DTXSID80182459;CAA81905;MFCD01075745;AKOS028108472;2-tert-Butylpropane-1,3-diol, 98%;NSC 268916;NSC-268916;3,3-Dimethyl-2-(hydroxymethyl)-1-butanol;LS-120201;CS-0263133;EN300-85269;A935192;Z1255427736

Suppliers and Price of 2-Tert-butylpropane-1,3-diol

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

American Custom Chemicals Corporation
2-TERT-BUTYL PROPANE-1,3-DIOL 95.00%
5MG
$ 505.37

Alfa Aesar
2-tert-Butylpropane-1,3-diol, 98%
1g
$ 47.00

Alfa Aesar
2-tert-Butylpropane-1,3-diol, 98%
5g
$ 158.00

AK Scientific
2-Tert-butylpropane-1,3-diol
500mg
$ 152.00

AK Scientific
2-Tert-butylpropane-1,3-diol
250mg
$ 147.00

AK Scientific
2-Tert-butylpropane-1,3-diol
100mg
$ 140.00

Total 10 raw suppliers

Chemical Property of 2-Tert-butylpropane-1,3-diol

Chemical Property:

Vapor Pressure:0.0329mmHg at 25°C
Melting Point:54-56°C
Boiling Point:100-102°C 2mm
Flash Point:94°C
PSA：40.46000
Density:0.947g/cm³
LogP:0.63330
XLogP3:0.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:3
Exact Mass:132.115029749
Heavy Atom Count:9
Complexity:69.5

Purity/Quality:

99% ^*data from raw suppliers

2-TERT-BUTYL PROPANE-1,3-DIOL 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:
Safety Statements: 22-24/25

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)(C)C(CO)CO

Technology Process of 2-Tert-butylpropane-1,3-diol

There total 7 articles about 2-Tert-butylpropane-1,3-diol 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: 84.8%

: 759-24-0
tert-butylmalonic acid diethyl ester

: 2819-05-8
2-tert-butylpropane-1,3-diol

Guidance literature:: With lithium aluminium tetrahydride; In diethyl ether; 1) 2 h, reflux, 2) overnight;
DOI:10.1016/S0040-4020(01)92198-2

Reference yield: 67.0%

: 55740-28-8
2-(tert-butyl)malonaldehyde

: 2819-05-8
2-tert-butylpropane-1,3-diol

Guidance literature:: With lithium aluminium tetrahydride;

Reference yield: 31.0%

: 1184-53-8
methylcopper

: 67-64-1
acetone

: 105-53-3
diethyl malonate

: 2819-05-8
2-tert-butylpropane-1,3-diol

Guidance literature:: acetone; diethyl malonate; With acetic anhydride; zinc(II) chloride; Heating;

methylcopper;

With lithium aluminium tetrahydride; In diethyl ether;
DOI:10.1016/j.tet.2014.12.098