4-(4-{[(2-Chloroethyl)carbamoyl]amino}phenyl)butanoic acid

Base Information

Chemical Name:4-(4-{[(2-Chloroethyl)carbamoyl]amino}phenyl)butanoic acid
CAS No.:13908-55-9
Molecular Formula:C13H17ClN2O3
Molecular Weight:284.7387
Hs Code.:
NSC Number:87421
DSSTox Substance ID:DTXSID40293151
Wikidata:Q82031777

Synonyms:13908-55-9;4-(4-{[(2-chloroethyl)carbamoyl]amino}phenyl)butanoic acid;NSC87421;DTXSID40293151;NSC-87421

Suppliers and Price of 4-(4-{[(2-Chloroethyl)carbamoyl]amino}phenyl)butanoic acid

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 4-(4-{[(2-Chloroethyl)carbamoyl]amino}phenyl)butanoic acid

Chemical Property:

Vapor Pressure:8.48E-09mmHg at 25°C
Boiling Point:447.7°Cat760mmHg
Flash Point:224.5°C
Density:1.296g/cm³
XLogP3:1.6
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:7
Exact Mass:284.0927701
Heavy Atom Count:19
Complexity:292

Purity/Quality:: 98%min ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=CC=C1CCCC(=O)O)NC(=O)NCCCl

Technology Process of 4-(4-{[(2-Chloroethyl)carbamoyl]amino}phenyl)butanoic acid

There total 3 articles about 4-(4-{[(2-Chloroethyl)carbamoyl]amino}phenyl)butanoic acid 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: 77.0%

: 1943-83-5
2-chloroethyl isothiocyanate

: 15118-60-2
4-(4-aminophenyl)butyric Acid

: 13908-55-9
4-phenyl>butyric acid

Guidance literature:: In 1,2-dimethoxyethane; for 24h;
DOI:10.1002/jps.2600770218

Reference yield:

: 5600-62-4
4-(4-nitrophenyl)butanoic acid

: 13908-55-9
4-phenyl>butyric acid

Guidance literature:: Multi-step reaction with 2 steps

1: 90 percent / H₂, sodium methanoate / Pd/C / methanol

2: 77 percent / 1,2-dimethoxy-ethane / 24 h

With sodium methanoate; hydrogen; palladium on activated charcoal; In methanol; 1,2-dimethoxyethane;
DOI:10.1002/jps.2600770218

Reference yield:

: 1821-12-1
4-Phenylbutyric acid

: 13908-55-9
4-phenyl>butyric acid

Guidance literature:: Multi-step reaction with 3 steps

1: 22 percent / HNO₃ / 6 h / Ambient temperature

2: 90 percent / H₂, sodium methanoate / Pd/C / methanol

3: 77 percent / 1,2-dimethoxy-ethane / 24 h

With sodium methanoate; hydrogen; nitric acid; palladium on activated charcoal; In methanol; 1,2-dimethoxyethane;
DOI:10.1002/jps.2600770218