Deuteromethanol

Base Information

• Chemical Name: Deuteromethanol
• CAS No.: 4206-31-9
• Molecular Formula: CH3 D O
• Molecular Weight: 33.0342
• European Community (EC) Number: 689-483-2
• Nikkaji Number: J665.878D
• Mol file: 4206-31-9.mol

Synonyms:Deuteromethanol;deuteriomethanol;Methyl-d1 Alcohol;4206-31-9;Methan-d1-ol;Methanol-d1;Monodeuteromethanol;Methanol-1-d, 98 atom % D;MFCD00190479;M0551;F91128

Chemical Property of Deuteromethanol

Chemical Property:

• Refractive Index: n20/D 1.326(lit.)
• Boiling Point: 48.1°Cat760mmHg
• Flash Point: 11.1°C
• PSA: 20.23000
• Density: 0.776g/cm³
• LogP: -0.39150
• XLogP3: -0.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 33.032491493
• Heavy Atom Count: 2
• Complexity: 2

Purity/Quality:

Methanol-d ^*data from reagent suppliers

Safty Information:

• Hazard Codes: F,T
• Statements: 11-23/25-39/23/24/25-23/24/25
• Safety Statements: 7-16-24-45-36/37

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CO
• Isomeric SMILES: [2H]CO
• Uses: Methanol-d is an isotope labelled version of Methanol (M276585). Methanol (M276585) is a common chemical reagent in organic synthesis participating in a variety of reactions. Methanol is a bioactive component with antimicrobial activities.

Technology Process of Deuteromethanol

There total 3 articles about Deuteromethanol 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:

d7-N,N-dimethylformamide (4472-41-7,185990-36-7) → deuteriomethanol (4206-31-9)

Guidance literature:

With bis(cyclopentadienyl)titanium dichloride; sodium tetrahydroborate; Yield given. Multistep reaction; 1.) 96 deg C, 1 h;

DOI:10.1021/jo00070a045

Reference yield:

formaldehyd (50-00-0,30525-89-4,61233-19-0) → deuteriomethanol (4206-31-9)

Guidance literature:

With sodium borodeuteride;

DOI:10.1016/0584-8539(82)80161-X

Reference yield:

→ deuteriomethanol (4206-31-9)

Guidance literature:

upstream raw materials:

formaldehyd

d₇-N,N-dimethylformamide

Downstream raw materials:

2,4-dimethylquinoline

<2H1>methyl iodide

Co(C₅H₅)(P(C₆H₅)3)CH₂CH₂CH⁽²⁾HC(O)

Co(C₅H₅)(P(C₆H₅)3)CH₂CH₂CH⁽²⁾HC(O)

Refernces

• 1、 Liu, Yumin,Schwartz, Jeffrey. "The Species Prepared from Sodium Borohydride and N,N-Dimethylformamide Reduces or Dimethylaminates Organic Halides". . p. 5005 - 5007. Retrieved 2007/10/02.