2,3-Dimethyl-2-pentanol

Base Information

• Chemical Name: 2,3-Dimethyl-2-pentanol
• CAS No.: 4911-70-0
• Molecular Formula: C7H16 O
• Molecular Weight: 116.203
• European Community (EC) Number: 225-538-5
• NSC Number: 27243
• UNII: XDE2VG2YXY
• DSSTox Substance ID: DTXSID90875704
• Nikkaji Number: J113.346B
• Mol file: 4911-70-0.mol

Synonyms:2,3-DIMETHYL-2-PENTANOL;2,3-Dimethylpentan-2-ol;4911-70-0;2-Pentanol, 2,3-dimethyl-;XDE2VG2YXY;50819-06-2;EINECS 225-538-5;NSC 27243;NSC-27243;NSC27243;UNII-XDE2VG2YXY;2-Pentanol,3-dimethyl-;SCHEMBL213668;YRSIFCHKXFKNME-UHFFFAOYSA-;DTXSID90875704;EN300-1830964

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

Chemical Property:

• Vapor Pressure: 2.83mmHg at 25°C
• Melting Point: -30.45°C (estimate)
• Refractive Index: 1.4230
• Boiling Point: 138.3°Cat760mmHg
• PKA: 15.38±0.29(Predicted)
• Flash Point: 42.3°C
• PSA: 20.23000
• Density: 0.818g/cm³
• LogP: 1.80340
• Water Solubility.: 15.17g/L(25 oC)
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 116.120115130
• Heavy Atom Count: 8
• Complexity: 66.8

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Chemical Classes: Solvents -> Alcohols (
• Canonical SMILES: CCC(C)C(C)(C)O

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

There total 12 articles about 2,3-Dimethyl-2-pentanol 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:

cefoperazone (62893-19-0,68779-10-2) → 2-methylthiazol-4-carbonitrile (21917-76-0) + pyrrolidine-3-carboxylic acid (59378-87-9,68464-02-8,72580-53-1,72580-54-2) + 2,3-dimethylpentan-2-ol (4911-70-0) + 1-Methoxy-2-methylpropan-2-ol (3587-64-2) + 5-hydroxy-4-oxopentanoic acid (15925-30-1) + 1,3-dimethyl-5-pyrazolone (2749-59-9) + formic acid ethyl ester (109-94-4)

Guidance literature:

With sodium hydroxide; for 1.33333h; pH=9; Kinetics; Irradiation;

DOI:10.1016/j.molliq.2021.117479

Reference yield:

2,3-dimethylpent-4-en-2-ol (19781-52-3) → 2,3-dimethylpentan-2-ol (4911-70-0)

Guidance literature:

With methanol; platinum(IV) oxide; Hydrogenation;

DOI:10.1021/ja01217a052

Reference yield:

sec-butylmagnesium bromide (671795-46-3) + acetone (67-64-1) → 2,3-dimethylpentan-2-ol (4911-70-0)

Guidance literature:

With diethyl ether;

upstream raw materials:

trimethyloxirane

diethyl ether

diethylmagnesium

2,3-dimethylpent-4-en-2-ol

Downstream raw materials:

2-Chlor-2,3-dimethylpentan

(1,1,2-trimethyl-butyl)-benzene

(+/-)-4-Hydroxy-1-(1.1.2-trimethyl-butyl)-benzol

2,3-dimethyl pentane

Refernces

• 1、 Kirmse, Wolfgang,Prolingheuer, Ernst-Christoph. "Stereochemistry of Aliphatic Carbocations, 12. Alkyl Shifts between Secondary Carbon Atoms". . p. 104 - 128. Retrieved 2007/10/02.