1,3-Propanediol, 2-methyl-2-propyl-, bis(methylcarbamate)

Base Information

• Chemical Name: 1,3-Propanediol, 2-methyl-2-propyl-, bis(methylcarbamate)
• CAS No.: 25658-37-1
• Molecular Formula: C₁₁H₂₂N₂O₄
• Molecular Weight: 246.307
• Hs Code.: 2924199090
• DSSTox Substance ID: DTXSID20180353
• Nikkaji Number: J50.876D
• Wikidata: Q83050889
• Mol file: 25658-37-1.mol

Synonyms:1,3-Propanediol, 2-methyl-2-propyl-, bis(methylcarbamate);BRN 1877932;25658-37-1;2-Methyl-2-propyl-1,3-propanediol bis(methylcarbamate);DTXSID20180353;LS-120624;Carbamic acid, methyl-, 2-methyl-2-propyltrimethylene ester;Bis(N-methylcarbamic acid)2-methyl-2-propyltrimethylene ester

Chemical Property of 1,3-Propanediol, 2-methyl-2-propyl-, bis(methylcarbamate)

Chemical Property:

• Vapor Pressure: 3.4E-06mmHg at 25°C
• Boiling Point: 387°Cat760mmHg
• Flash Point: 187.9°C
• PSA: 83.64000
• Density: 1.049g/cm³
• LogP: 1.91360
• XLogP3: 1.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 8
• Exact Mass: 246.15795719
• Heavy Atom Count: 17
• Complexity: 236

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCC(C)(COC(=O)NC)COC(=O)NC

Technology Process of 1,3-Propanediol, 2-methyl-2-propyl-, bis(methylcarbamate)

There total 1 articles about 1,3-Propanediol, 2-methyl-2-propyl-, bis(methylcarbamate) 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:

phosgene (75-44-5) + 2-methyl-2-propyl-1,3-propanediol (78-26-2) + methylamine (74-89-5) → N,N'-Dimethyl-2-methyl-2-propyl-propandiol-(1.3)-dicarbamat (25658-37-1)

Guidance literature:

Multistep reaction; (i) PhNMe₂, (ii) /BRN= 741851/;

DOI:10.1007/BF00900274

upstream raw materials:

phosgene

2-methyl-2-propyl-1,3-propanediol

methylamine