Dimethyl 3-hydroxydecanedioate

Base Information

• Chemical Name: Dimethyl 3-hydroxydecanedioate
• CAS No.: 93090-88-1
• Molecular Formula: C₁₂H₂₂O₅
• Molecular Weight: 246.304
• Hs Code.: 2918199090
• DSSTox Substance ID: DTXSID10918723
• Mol file: 93090-88-1.mol

Synonyms:3-HDADE;3-hydroxydecandioic acid dimethylate;3-hydroxydecanedioc acid dimethyl ester;dimethyl 3-hydroxydecanedioate

Chemical Property of Dimethyl 3-hydroxydecanedioate

Chemical Property:

• Vapor Pressure: 6.81E-05mmHg at 25°C
• Boiling Point: 307.2°Cat760mmHg
• Flash Point: 103.7°C
• PSA: 72.83000
• Density: 1.064g/cm³
• LogP: 1.42400
• XLogP3: 1.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 11
• Exact Mass: 246.14672380
• Heavy Atom Count: 17
• Complexity: 227

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC(=O)CCCCCCC(CC(=O)OC)O

Technology Process of Dimethyl 3-hydroxydecanedioate

There total 2 articles about Dimethyl 3-hydroxydecanedioate 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:

cis-Cyclooctene (931-88-4,931-87-3,25267-51-0) → dimethyl 3-hydroxydecanedioate (93090-88-1)

Guidance literature:

Multi-step reaction with 2 steps

2: activated zinc dust / benzene; diethyl ether / 3 h / Heating

With zinc; In diethyl ether; benzene;

DOI:10.1002/oms.1210220708

Reference yield:

methyl 8-oxooctanoate (3884-92-2) + bromoacetic acid methyl ester (96-32-2) → dimethyl 3-hydroxydecanedioate (93090-88-1)

Guidance literature:

With zinc; In diethyl ether; benzene; for 3h; Yield given; Heating;

DOI:10.1002/oms.1210220708

upstream raw materials:

methyl 8-oxooctanoate

bromoacetic acid methyl ester

cis-Cyclooctene