2-Hydroxypropyl carbamate

Base Information

• Chemical Name: 2-Hydroxypropyl carbamate
• CAS No.: 17464-96-9
• Deprecated CAS: 145639-05-0
• Molecular Formula: C4H9NO3
• Molecular Weight: 119.12
• European Community (EC) Number: 614-981-3,939-481-5
• NSC Number: 513448,53634
• UNII: LQY6DWT7E2
• DSSTox Substance ID: DTXSID70932662
• Nikkaji Number: J1.074.668J

Synonyms:2-hydroxypropyl carbamate;17464-96-9;2-Hydroxypropylcarbamate;Carbamic acid, 2-hydroxypropyl ester;1,2-Propanediol, 1-carbamate;LQY6DWT7E2;AI3-22928;1,2-Propanediol, monocarbamate;1, 1-carbamate;NSC-53634;NSC-513448;69493-47-6;UNII-LQY6DWT7E2;beta-hydroxypropyl carbamate;1,2-Propanediol 1-carbamate;SCHEMBL139619;DTXSID70932662;YCDWNZGUODQFGU-UHFFFAOYSA-N;NSC53634;NSC 53634;NSC513448;2-Hydroxypropyl hydrogen carbonimidate;AKOS006341439;NSC 513448;145639-05-0

Chemical Property of 2-Hydroxypropyl carbamate

Chemical Property:

• Refractive Index: 1.479
• Boiling Point: 294.5°Cat760mmHg
• Flash Point: 131.9°C
• Density: 1.195g/cm³
• XLogP3: -0.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 119.058243149
• Heavy Atom Count: 8
• Complexity: 83.4

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(COC(=O)N)O

Technology Process of 2-Hydroxypropyl carbamate

There total 8 articles about 2-Hydroxypropyl carbamate 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: 63.1%

carbon dioxide (124-38-9,18923-20-1) + cyclohexylamine (108-91-8,157973-60-9) + methyloxirane (75-56-9,16033-71-9) → 2-hydroxypropyl carbamate (17464-96-9) + 1,3-Dicyclohexylurea (2387-23-7)

Guidance literature:

cyclohexylamine; methyloxirane; With 1-butyl-3-methylimidazolium tetraiodoindate; In toluene; at 20 ℃; for 0.0833333h; Autoclave;

carbon dioxide; In toluene; at 150 ℃; for 2h; under 62256.2 Torr; Catalytic behavior; Autoclave;

DOI:10.1002/bkcs.11363

Reference yield: 20.2%

1,2-propylene cyclic carbonate (108-32-7) + carbon dioxide (124-38-9,18923-20-1) + cyclohexylamine (108-91-8,157973-60-9) → 1-(cyclohexylamino)-2-propanol (103-00-4) + 2-hydroxypropyl carbamate (17464-96-9) + 3-cyclohexyl-5-methyloxazolidone (96014-95-8) + 1,3-Dicyclohexylurea (2387-23-7)

Guidance literature:

With [Bmim]₂[ZnCl₂Br₂]; In tetrahydrofuran; at 150 ℃; for 2h; under 62256.2 Torr; Autoclave;

DOI:10.1002/bkcs.11363

Reference yield: 19.8%

carbon dioxide (124-38-9,18923-20-1) + cyclohexylamine (108-91-8,157973-60-9) + methyloxirane (75-56-9,16033-71-9) → 1-(cyclohexylamino)-2-propanol (103-00-4) + 2-hydroxypropyl carbamate (17464-96-9) + 3-cyclohexyl-5-methyloxazolidone (96014-95-8) + 1,3-Dicyclohexylurea (2387-23-7)

Guidance literature:

cyclohexylamine; methyloxirane; With 1-butyl-3-methylimidazolium tetraiodoindate; sodium chloride; In toluene; at 20 ℃; for 0.0833333h; Autoclave;

carbon dioxide; In toluene; at 150 ℃; for 2h; under 62256.2 Torr; Autoclave;

DOI:10.1002/bkcs.11363

upstream raw materials:

carbon dioxide

cyclohexylamine

methyloxirane

1,2-propylene cyclic carbonate

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