1-(3-Chloropropyl)-1-nitroso-3-phenylurea

Base Information

Chemical Name:1-(3-Chloropropyl)-1-nitroso-3-phenylurea
CAS No.:16183-21-4
Molecular Formula:C12H19N
Molecular Weight:177.289
Hs Code.:
NSC Number:81700
DSSTox Substance ID:DTXSID40292321
Wikidata:Q82030584
Mol file:16183-21-4.mol

Synonyms:1-(3-chloropropyl)-1-nitroso-3-phenylurea;NSC81700;DTXSID40292321;NSC-81700;13907-69-2

Suppliers and Price of 1-(3-Chloropropyl)-1-nitroso-3-phenylurea

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

TRC
N-(4-methylbenzyl)butan-1-amine
10mg
$ 45.00

American Custom Chemicals Corporation
N-(4-METHYLBENZYL)BUTAN-1-AMINE 95.00%
1G
$ 685.21

American Custom Chemicals Corporation
N-(4-METHYLBENZYL)BUTAN-1-AMINE 95.00%
10G
$ 1479.56

American Custom Chemicals Corporation
N-(4-METHYLBENZYL)BUTAN-1-AMINE 95.00%
5G
$ 1018.71

Acrotein
N-(4-Methylbenzyl)butan-1-amine 97%
25g
$ 770.00

A1 Biochem Labs
N-(4-Methylbenzyl)butan-1-amine 95%
5 g
$ 200.00

Total 9 raw suppliers

Chemical Property of 1-(3-Chloropropyl)-1-nitroso-3-phenylurea

Chemical Property:

Vapor Pressure:0.018mmHg at 25°C
Boiling Point:253.7°C at 760 mmHg
PKA:10.08±0.19(Predicted)
Flash Point:103°C
PSA：12.03000
Density:0.9g/cm³
LogP:3.27560
XLogP3:2.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:241.0618043
Heavy Atom Count:16
Complexity:232

Purity/Quality:

99.90% ^*data from raw suppliers

N-(4-methylbenzyl)butan-1-amine ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

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

Technology Process of 1-(3-Chloropropyl)-1-nitroso-3-phenylurea

There total 10 articles about 1-(3-Chloropropyl)-1-nitroso-3-phenylurea 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: 54.0%

: 104-85-8
para-methylbenzonitrile

: 109-73-9,85404-21-3
N-butylamine

: 16183-21-4
N-(4-methylbenzyl)butan-1-amine

Guidance literature:: With borane-ammonia complex; C₁₇H₁₆BrMnN₂O₃S; In isopropyl alcohol; at 80 ℃; for 24h;
DOI:10.1021/acscatal.0c05406

Reference yield:

: 154777-46-5
N-(p-methylbenzyl)cyclobutylamine

: 16183-21-4
N-(4-methylbenzyl)butan-1-amine

Guidance literature:: Multi-step reaction with 2 steps

1: 44 percent / toluene / 1 h / Heating

2: 1.) Bu₃SnH, AIBN; 2.) NaBH₄ / 1.) cyclohexane, 2 h, reflux; 2.) DMF/cyclohexane, r.t.

With sodium tetrahydroborate; 2,2'-azobis(isobutyronitrile); tri-n-butyl-tin hydride; In toluene;
DOI:10.1016/S0040-4020(01)80837-1

Reference yield:

: 138710-09-5
N-(benzenesulfenyl)-N-(p-methylbenzyl)cyclobutylamine

: 16183-21-4
N-(4-methylbenzyl)butan-1-amine

Guidance literature:: With sodium tetrahydroborate; 2,2'-azobis(isobutyronitrile); tri-n-butyl-tin hydride; Yield given. Multistep reaction; 1.) cyclohexane, 2 h, reflux; 2.) DMF/cyclohexane, r.t.;
DOI:10.1016/S0040-4020(01)80837-1