Cyclohexyl carbamate

Base Information

• Chemical Name: Cyclohexyl carbamate
• CAS No.: 1124-54-5
• Molecular Formula: C7H13 N O2
• Molecular Weight: 143.186
• Hs Code.: 2924299090
• NSC Number: 23561
• UNII: YCN5M8Q7C5
• DSSTox Substance ID: DTXSID20150031
• Nikkaji Number: J42.874D
• Wikidata: Q83015940
• Mol file: 1124-54-5.mol

Synonyms:Cyclohexyl carbamate;1124-54-5;Cyclohexylurethane;CARBAMIC ACID, CYCLOHEXYL ESTER;Carbamate, cyclohexyl;Carbamic acid cyclohexyl ester;Cyklohexylkarbamat;USAF EL-104;Cyklohexylkarbamat [Czech];cyclohexylcarbamate;NSC 23561;BRN 1861733;YCN5M8Q7C5;Cyklohexylester kyseliny karbaminove [Czech];Cyklohexylester kyseliny karbaminove;NSC-23561;4-06-00-00043 (Beilstein Handbook Reference);WLN: L6TJ AOVZ;UNII-YCN5M8Q7C5;SCHEMBL113152;DTXSID20150031;NSC23561;MFCD00092651;AKOS006340263;LS-49208;CS-0259577;EN300-736540

Chemical Property of Cyclohexyl carbamate

Chemical Property:

• Vapor Pressure: 0.00808mmHg at 25°C
• Boiling Point: 267.6°C at 760 mmHg
• Flash Point: 136.2°C
• PSA: 52.32000
• Density: 1.07g/cm³
• LogP: 2.11470
• XLogP3: 1.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 143.094628657
• Heavy Atom Count: 10
• Complexity: 119

Purity/Quality:

98%,99%, ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCC(CC1)OC(=O)N

Technology Process of Cyclohexyl carbamate

There total 6 articles about Cyclohexyl 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: 84.0%

potassium cyanate (590-28-3) + cyclohexanol (108-93-0) → carbamic acid cyclohexyl ester (1124-54-5)

Guidance literature:

With para-dodecylbenzenesulfonic acid; In neat (no solvent); at 60 ℃; for 0.5h; Green chemistry;

DOI:10.1039/c5ra14528g

Reference yield: 82.0%

urea (57-13-6) + cyclohexanol (108-93-0) → carbamic acid cyclohexyl ester (1124-54-5)

Guidance literature:

With cholin chloride ZnCl₂; iron oxide; at 130 ℃; for 6h; Green chemistry;

DOI:10.1002/ejoc.201800581

Reference yield: 81.0%

N-ethoxycarbonyl-(2,3,4,5-tetrachloro-1-thiophenio)amide (90454-50-5) → 2,3,4,5-tetrachlorothiophene (6012-97-1) + carbamic acid cyclohexyl ester (1124-54-5)

Guidance literature:

In cyclohexane; for 1h; Irradiation;

upstream raw materials:

urea

cyclohexanol

cyclohexyl chloroformate

N-ethoxycarbonyl-(2,3,4,5-tetrachloro-1-thiophenio)amide

Downstream raw materials:

(4-Chloro-benzenesulfonyl)-cyclohexyloxycarbonylamino-acetic acid

(4-Acetylamino-benzenesulfonyl)-cyclohexyloxycarbonylamino-acetic acid

Cyclohexyloxycarbonylamino-(2,5-dichloro-benzenesulfonyl)-acetic acid

Cyclohexyloxycarbonylamino-(3,4,5-trimethoxy-benzenesulfonyl)-acetic acid

Refernces

• 1、 Basu, Priyanka,Dey, Tusar Kanto,Ghosh, Aniruddha,Biswas, Surajit,Khan, Aslam,Islam, Sk. Manirul. "An efficient one-pot synthesis of industrially valuable primary organic carbamates and: N -substituted ureas by a reusable Merrifield anchored iron(ii)-anthra catalyst [FeII(Anthra-Merf)] using urea as a sustainable carbonylation source". . p. 2630 - 2643. Retrieved 2020.
• 2、 Sardarian, Ali Reza,Dindarloo Inaloo, Iman,Zangiabadi, Milad. "An Fe3O4@SiO2/Schiff base/Cu(ii) complex as an efficient recyclable magnetic nanocatalyst for selective mono: N-arylation of primary O-alkyl thiocarbamates and primary O-alkyl carbamates with aryl halides and arylboronic acids". . p. 8557 - 8565. Retrieved 2019/06/14.