2-Cyclopentyl-2-propanol

Base Information

• Chemical Name: 2-Cyclopentyl-2-propanol
• CAS No.: 1462-06-2
• Molecular Formula: C8H16 O
• Molecular Weight: 128.214
• Hs Code.: 2906199090
• European Community (EC) Number: 872-758-8
• NSC Number: 44140
• UNII: W8H8UZA4NN
• DSSTox Substance ID: DTXSID70286192
• Nikkaji Number: J100.639H
• Wikidata: Q82021836
• Mol file: 1462-06-2.mol

Synonyms:2-Cyclopentyl-2-propanol;2-cyclopentylpropan-2-ol;1462-06-2;Cyclopentanemethanol, a,a-dimethyl-;a,a-Dimethyl-cyclopentanemethanol;NSC-44140;Cyclopentanemethanol, .alpha.,.alpha.-dimethyl-;NSC44140;W8H8UZA4NN;2-cyclopentyl-propan-2-ol;1-Cyclopentyl-1-methylethanol;SCHEMBL844660;a,a-dimethyl cyclopentanemethanol;DTXSID70286192;BAA46206;NSC 44140;AKOS009997194;Cyclopentanemethanol,.alpha.-dimethyl-;alpha,alpha-Dimethylcyclopentanemethanol;alpha,alpha-Dimethyl-cyclopentanemethanol;Cyclopentanemethanol, alpha,alpha-dimethyl-;CS-0446914;EN300-55590;F79709

Chemical Property of 2-Cyclopentyl-2-propanol

Chemical Property:

• Vapor Pressure: 0.316mmHg at 25°C
• Boiling Point: 177.4°Cat760mmHg
• PKA: 15.40±0.29(Predicted)
• Flash Point: 70.3°C
• PSA: 20.23000
• Density: 0.942g/cm³
• LogP: 1.94750
• XLogP3: 2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 128.120115130
• Heavy Atom Count: 9
• Complexity: 90.7

Purity/Quality:

99% ^*data from raw suppliers

a,a-Dimethyl-cyclopentanemethanol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(C)(C1CCCC1)O

Technology Process of 2-Cyclopentyl-2-propanol

There total 8 articles about 2-Cyclopentyl-2-propanol 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:

6-methyl-5-hepten-1-ol (13175-35-4) → 1-cyclopentyl-1-methylethanol (1462-06-2)

Guidance literature:

Multi-step reaction with 2 steps

1: tetrahydrofuran

2: (i) HCO₂Na, HCO₂H, (ii) LiAlH₄, Et₂O

In tetrahydrofuran;

DOI:10.1021/ja01078a037

Reference yield:

methyl magnesium iodide (917-64-6) + methyl cyclopentane carboxylate (4630-80-2) → 1-cyclopentyl-1-methylethanol (1462-06-2)

Guidance literature:

DOI:10.1021/ja01078a037

Reference yield:

6-Methyl-hept-5-en-1-yl-<4-nitro-benzolsulfonat> (1462-04-0) → 6-methyl-5-hepten-1-ol (13175-35-4) + 2,2-dimethylcyclohexanol (1193-46-0) + 1-cyclopentyl-1-methylethanol (1462-06-2) + 1-isopropylcyclopentanol (1462-05-1)

Guidance literature:

Multistep reaction; (i) HCO₂Na, HCO₂H, (ii) LiAlH₄, Et₂O;

DOI:10.1021/ja01078a037

upstream raw materials:

methyl magnesium iodide

ethyl cyclopentanecarboxylate

methyl cyclopentane carboxylate

6-Methyl-hept-5-en-1-yl-<4-nitro-benzolsulfonat>

Downstream raw materials:

isopropylcyclopentane

1,2-dimethylcyclohexene

2-bromo-1,1-dimethyl-cyclohexane

(α-bromo-isopropyl)-cyclopentane

Refernces