3-(3-tert-Butylcyclohexyl)-1-(2-chloroethyl)-1-nitrosourea

Base Information

Chemical Name:3-(3-tert-Butylcyclohexyl)-1-(2-chloroethyl)-1-nitrosourea
CAS No.:33021-96-4
Molecular Formula:C₁₃H₂₄ClN₃O₂
Molecular Weight:289.805
Hs Code.:
NSC Number:110778
DSSTox Substance ID:DTXSID50954640
Nikkaji Number:J49.094F
ChEMBL ID:CHEMBL274338
Mol file:33021-96-4.mol

Synonyms:3-(3-tert-Butylcyclohexyl)-1-(2-chloroethyl)-1-nitrosourea;33021-96-4;Urea, 3-(3-tert-butylcyclohexyl)-1-(2-chloroethyl)-1-nitroso-;BRN 3973033;NSC 110778;CHEMBL274338;DTXSID50954640;NSC110778;NSC-110778;N'-(3-tert-Butylcyclohexyl)-N-(2-chloroethyl)-N-nitrosocarbamimidic acid

Suppliers and Price of 3-(3-tert-Butylcyclohexyl)-1-(2-chloroethyl)-1-nitrosourea

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
Packaging
price

American Custom Chemicals Corporation
3-(3-TERT-BUTYLCYCLOHEXYL)-1-(2-CHLOROETHYL)-1-NITROSOUREA 95.00%
5MG
$ 503.94

Total 5 raw suppliers

Chemical Property of 3-(3-tert-Butylcyclohexyl)-1-(2-chloroethyl)-1-nitrosourea

Chemical Property:

Boiling Point:°Cat760mmHg
Flash Point:°C
PSA：61.77000
Density:1.2g/cm³
LogP:3.91400
XLogP3:4.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:289.1557047
Heavy Atom Count:19
Complexity:318

Purity/Quality:

99% ^*data from raw suppliers

3-(3-TERT-BUTYLCYCLOHEXYL)-1-(2-CHLOROETHYL)-1-NITROSOUREA 95.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)(C)C1CCCC(C1)NC(=O)N(CCCl)N=O

Technology Process of 3-(3-tert-Butylcyclohexyl)-1-(2-chloroethyl)-1-nitrosourea

There total 2 articles about 3-(3-tert-Butylcyclohexyl)-1-(2-chloroethyl)-1-nitrosourea 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:

: 33082-85-8
(+/-)-N--N'-<2-chlor-aethyl>-harnstoff

: 33021-96-4,74751-36-3
(+/-)-N'--N-<2-chlor-aethyl>-N-nitroso-harnstoff

Guidance literature:: With sodium nitrite; In formic acid;
DOI:10.1021/jm00289a011

Reference yield:

: (1R,3R)-3-tert-Butyl-cyclohexylamine; hydrochloride

: 33021-96-4,74751-36-3
(+/-)-N'--N-<2-chlor-aethyl>-N-nitroso-harnstoff

Guidance literature:: Multi-step reaction with 2 steps

1: Et₃N

2: NaNO₂ / formic acid

With triethylamine; sodium nitrite; In formic acid;
DOI:10.1021/jm00289a011