Bicyclo[3.2.1]octan-2-ol

Base Information

• Chemical Name: Bicyclo[3.2.1]octan-2-ol
• CAS No.: 5602-48-2
• Molecular Formula: C8H14O
• Molecular Weight: 126.199
• NSC Number: 408795
• DSSTox Substance ID: DTXSID50941414
• Nikkaji Number: J113.221K
• Mol file: 5602-48-2.mol

Synonyms:Bicyclo[3.2.1]octan-2-ol;1965-38-4;5602-48-2;rac-(1R,2R,5R)-Bicyclo[3.2.1]octan-2-ol, exo;EXOBICYCLO(3.2.1)-2-OCTANOL;NSC408795;OC1CCC2CCC1C2;NCIOpen2_003578;SCHEMBL2884397;DTXSID50941414;PVDVHTXERCKKSW-UHFFFAOYSA-N;BAA96538;Bicyclo[3.2.1]octan-2-ol, exo-;NSC-408795;EN300-701176

Chemical Property of Bicyclo[3.2.1]octan-2-ol

Chemical Property:

• Vapor Pressure: 0.0459mmHg at 25°C
• Refractive Index: 1.521
• Boiling Point: 209.7°Cat760mmHg
• Flash Point: 84°C
• PSA: 20.23000
• Density: 1.052g/cm³
• LogP: 1.55740
• XLogP3: 1.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 126.104465066
• Heavy Atom Count: 9
• Complexity: 111

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC2CC1CCC2O

Technology Process of Bicyclo[3.2.1]octan-2-ol

There total 22 articles about Bicyclo[3.2.1]octan-2-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: 92.0%

bicyclo<3.2.1>-octan-2-one (5019-82-9) → endo-bicyclo<3.2.1>-octan-2-ol (1965-38-4,5602-48-2,53519-18-9,61277-91-6)

Guidance literature:

With ammonia; lithium; In methanol; diethyl ether; at -78 ℃; for 1h;

DOI:10.1039/P29840000119

Reference yield: 92.0%

endo-bicyclo<3.2.1>octan-2-yl toluene-p-sulphonate (19773-33-2,19773-34-3,58729-80-9,74844-78-3) → Bicyclo<3.2.1>octan-exo-2-ol (1965-38-4) + endo-bicyclo<3.2.1>-octan-2-ol (1965-38-4,5602-48-2,53519-18-9,61277-91-6)

Guidance literature:

With water; In ethanol; at 40 ℃; Title compound not separated from byproducts; solvolysis;

DOI:10.1016/S0040-4039(01)81871-2

Reference yield:

→ bicyclo[3.2.1]octan-2-one (5019-82-9) + endo-bicyclo<3.2.1>-octan-2-ol (1965-38-4,5602-48-2,53519-18-9,61277-91-6)

Guidance literature:

With methanol; Pd-BaSO₄; Hydrogenation;

DOI:10.1021/ja01467a032

upstream raw materials:

2-bromo-bicyclo[3.2.1]octane

bicyclo[2,2,2]octane

trifluoroacetic acid

bicyclo[3.2.1]octan-2-one

Downstream raw materials:

bicyclo[3.2.1]octan-2-one

Bicyclo<3.2.1>octan-exo-2-ol

endo-bicyclo<3.2.1>-octan-2-ol

endo-bicyclo<3.2.1>octan-2-yl toluene-p-sulphonate