Carbamic acid, cyclopropylmethyl-, phenylmethyl ester

Base Information

• Chemical Name: Carbamic acid, cyclopropylmethyl-, phenylmethyl ester
• CAS No.: 88048-44-6
• Molecular Formula: C12H15NO2
• Molecular Weight: 205.257
• DSSTox Substance ID: DTXSID90697504
• Nikkaji Number: J3.093.373G
• Wikidata: Q82627421
• Mol file: 88048-44-6.mol

Synonyms:Carbamic acid, cyclopropylmethyl-, phenylmethyl ester;88048-44-6;benzyl N-(cyclopropylmethyl)carbamate;SCHEMBL8393648;DTXSID90697504;Benzyl (cyclopropylmethyl)carbamate;N-(Benzyloxycarbonyl)cyclopropanemethaneamine

Chemical Property of Carbamic acid, cyclopropylmethyl-, phenylmethyl ester

Chemical Property:

• XLogP3: 2.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 205.110278721
• Heavy Atom Count: 15
• Complexity: 208

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC1CNC(=O)OCC2=CC=CC=C2

Technology Process of Carbamic acid, cyclopropylmethyl-, phenylmethyl ester

There total 2 articles about Carbamic acid, cyclopropylmethyl-, phenylmethyl ester 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: 91.0%

N-carbobenzyloxycyclopropylamine (88048-43-5) + methyl iodide (74-88-4) → N-carbobenzyloxy-N-methylcyclopropylamine (88048-44-6)

Guidance literature:

N-carbobenzyloxycyclopropylamine; With sodium hydride; In tetrahydrofuran; mineral oil; at 0 ℃; for 1h; Inert atmosphere;

methyl iodide; In tetrahydrofuran; mineral oil; at 0 - 20 ℃; for 18h; Inert atmosphere;

DOI:10.1021/ja511335v

Reference yield:

benzyl chloroformate (501-53-1,94274-21-2) → N-carbobenzyloxy-N-methylcyclopropylamine (88048-44-6)

Guidance literature:

Multi-step reaction with 2 steps

1: Na₂CO₃ / toluene; H₂O / 5 - 21 °C

2: 1) NaH / 1) DMF

With sodium hydride; sodium carbonate; In water; toluene;

DOI:10.1002/jhet.5570200438

Reference yield: 94.0%

di(rhodium)tetracarbonyl dichloride + carbon monoxide (201230-82-2) + N-carbobenzyloxy-N-methylcyclopropylamine (88048-44-6) → C28H30Cl2N2O8Rh2

Guidance literature:

at 60 ℃; for 48h; Inert atmosphere;

DOI:10.1021/ja511335v

upstream raw materials:

N-carbobenzyloxycyclopropylamine

methyl iodide

benzyl chloroformate