Cyclohexanecarboxylic acid, 1-(3-(2-chloroethyl)-3-nitrosoureido)-, ethyl ester

Base Information

Chemical Name:Cyclohexanecarboxylic acid, 1-(3-(2-chloroethyl)-3-nitrosoureido)-, ethyl ester
CAS No.:13991-74-7
Molecular Formula:C₁₂H₂₀ClN₃O₄
Molecular Weight:305.761
Hs Code.:2924299090
NSC Number:95443
DSSTox Substance ID:DTXSID10161196
Nikkaji Number:J75.364E
Wikidata:Q83029554
ChEMBL ID:CHEMBL12687
Mol file:13991-74-7.mol

Synonyms:13991-74-7;Cyclohexanecarboxylic acid, 1-(3-(2-chloroethyl)-3-nitrosoureido)-, ethyl ester;1-(3-(2-Chloroethyl)-3-nitrosoureido)cyclohexanecarboxylic acid ethyl ester;ethyl 1-[[2-chloroethyl(nitroso)carbamoyl]amino]cyclohexane-1-carboxylate;Cyclohexanecarboxylic acid, 1-[3-(2-chloroethyl)-3-nitrosoureido]-, ethyl ester;1-[3-(2-Chloroethyl)-3-nitrosoureido]cyclohexanecarboxylic acid ethyl ester;NSC 95443;Cyclohexanecarboxylic acid,;BRN 2885796;NSC95443;CHEMBL12687;DTXSID10161196;NSC-95443;Cyclohexanecarboxylic acid, 1-((((2-chloroethyl)nitrosoamino)carbonyl)amino)-,

Suppliers and Price of Cyclohexanecarboxylic acid, 1-(3-(2-chloroethyl)-3-nitrosoureido)-, ethyl ester

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
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price

Total 6 raw suppliers

Chemical Property of Cyclohexanecarboxylic acid, 1-(3-(2-chloroethyl)-3-nitrosoureido)-, ethyl ester

Chemical Property:

Boiling Point:°Cat760mmHg
Flash Point:°C
PSA：88.07000
Density:1.33g/cm³
LogP:2.57510
XLogP3:2.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:305.1142338
Heavy Atom Count:20
Complexity:359

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CCOC(=O)C1(CCCCC1)NC(=O)N(CCCl)N=O

Technology Process of Cyclohexanecarboxylic acid, 1-(3-(2-chloroethyl)-3-nitrosoureido)-, ethyl ester

There total 2 articles about Cyclohexanecarboxylic acid, 1-(3-(2-chloroethyl)-3-nitrosoureido)-, ethyl 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:

: 1664-34-2
1-amino-1-cyclohexanecarboxylic acid ethyl ester

: 13991-74-7
1-({[(2-chloroethyl)nitrosoamino]carbonyl}amino)-cyclohexanecarboxylic acid, ethyl ester

Guidance literature:: Multi-step reaction with 2 steps

1: diethyl ether

2: NaNO₂, HCO₂H

With formic acid; sodium nitrite; In diethyl ether;
DOI:10.1021/jm00324a026