Phosphonic acid, bicyclo[2.2.1]hept-2-yl-, dimethyl ester, endo-

Base Information

• Chemical Name: Phosphonic acid, bicyclo[2.2.1]hept-2-yl-, dimethyl ester, endo-
• CAS No.: 31061-88-8
• Molecular Formula: C₉H₁₇O₃P
• Molecular Weight: 204.206
• NSC Number: 138990
• DSSTox Substance ID: DTXSID30953171
• Mol file: 31061-88-8.mol

Synonyms:31061-88-8;DTXSID30953171;AFYAXLIVZXULKL-UHFFFAOYSA-N;NSC138990;Phosphonic acid, bicyclo[2.2.1]hept-2-yl-, dimethyl ester, endo-;NSC-138990;Dimethyl bicyclo[2.2.1]hept-2-ylphosphonate #;DIMETHYL BICYCLO[2.2.1]HEPTAN-2-YLPHOSPHONATE

Chemical Property of Phosphonic acid, bicyclo[2.2.1]hept-2-yl-, dimethyl ester, endo-

Chemical Property:

• Vapor Pressure: 0.00702mmHg at 25°C
• Boiling Point: 278.9°C at 760 mmHg
• Flash Point: 136.4°C
• Density: 1.13g/cm³
• XLogP3: 1.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 204.09153140
• Heavy Atom Count: 13
• Complexity: 233

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COP(=O)(C1CC2CCC1C2)OC

Technology Process of Phosphonic acid, bicyclo[2.2.1]hept-2-yl-, dimethyl ester, endo-

There total 8 articles about Phosphonic acid, bicyclo[2.2.1]hept-2-yl-, dimethyl ester, endo- 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: 85.0%

norborn-2-ene (498-66-8) + Dimethyl phosphite (868-85-9) → (+/-)-exo-2-(dimethoxyphosphoryl)bicyclo<2.2.1>heptane (31061-88-8,50457-69-7)

Guidance literature:

With dibenzoyl peroxide; In benzene; at 120 ℃; for 0.5h;

DOI:10.1080/10426509608037970

Reference yield: 60.0%

sodium methylate (124-41-4) + (+/-)-exo-2-(dichlorophosphoryl)bicyclo[2.2.1]heptane → (+/-)-exo-2-(dimethoxyphosphoryl)bicyclo<2.2.1>heptane (31061-88-8,50457-69-7)

Guidance literature:

In methanol; for 1h; Ambient temperature;

DOI:10.1080/10426509608037970

Reference yield:

dimethyl 2-norbornylphosphonite (73787-70-9,73787-77-6) → (+/-)-exo-2-(dimethoxyphosphoryl)bicyclo<2.2.1>heptane (31061-88-8,50457-69-7) + dimethyl endo-2-norbornylphosphonate (31061-88-8,50457-69-7)

Guidance literature:

With 3-chloro-benzenecarboperoxoic acid; In dichloromethane; at 0 ℃; for 1.25h; Yield given. Yields of byproduct given. Title compound not separated from byproducts;

DOI:10.1021/ja00529a042

upstream raw materials:

dimethyl 2-norbornylphosphonite

sodium methylate

norborn-2-ene

Dimethyl phosphite