N-Methyl-N'-(4-chlorophenyl)-N-nitrosourea

Base Information

Chemical Name:N-Methyl-N'-(4-chlorophenyl)-N-nitrosourea
CAS No.:25355-61-7
Molecular Formula:C8H8 Cl N3 O2
Molecular Weight:213.623
Hs Code.:2924299090
NSC Number:68455
UNII:CB8W5V5BQX
DSSTox Substance ID:DTXSID50180003
Nikkaji Number:J59.439C
Wikidata:Q83050501
Mol file:25355-61-7.mol

Synonyms:N-methyl-N'-(4-chlorophenyl)-N-nitrosourea;N-methyl-N'-(p-chlorophenyl)-N-nitrosourea

Suppliers and Price of N-Methyl-N'-(4-chlorophenyl)-N-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

Total 8 raw suppliers

Chemical Property of N-Methyl-N'-(4-chlorophenyl)-N-nitrosourea

Chemical Property:

Melting Point:114-115 °C (decomp)
Refractive Index:1.5560 (estimate)
Boiling Point:°Cat760mmHg
PKA:12.00±0.70(Predicted)
Flash Point:°C
PSA：61.77000
Density:1.36g/cm³
LogP:2.55810
XLogP3:2.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:213.0305042
Heavy Atom Count:14
Complexity:217

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CN(C(=O)NC1=CC=C(C=C1)Cl)N=O

Technology Process of N-Methyl-N'-(4-chlorophenyl)-N-nitrosourea

There total 5 articles about N-Methyl-N'-(4-chlorophenyl)-N-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: 95.0%

: 5352-88-5
3-(4-chlorophenyl)-1-methylurea

: 25355-61-7
1-(4-chlorophenyl)-3-isopropyl-3-nitrosourea

Guidance literature:: With sodium nitrite; In formic acid; at 0 - 5 ℃; for 0.5h;

Reference yield: 93.0%

: 5352-88-5
3-(4-chlorophenyl)-1-methylurea

: 25355-61-7
1-(4-chlorophenyl)-3-isopropyl-3-nitrosourea

: 110396-88-8
C₈H₈ClN₃O₂

Guidance literature:: With isopentyl nitrite; In chloroform; at 0 - 5 ℃; for 10h;

Reference yield:

: 106-47-8
4-chloro-aniline

: 25355-61-7
1-(4-chlorophenyl)-3-isopropyl-3-nitrosourea

Guidance literature:: Multi-step reaction with 2 steps

1: CHCl₃

2: aq. NaNO₂, HCO₂H

With formic acid; sodium nitrite; In chloroform;
DOI:10.1021/jm00342a010