N-(2-Chloroethyl)-N'-[2-(2-pyridinyl)ethyl]urea

Base Information

• Chemical Name: N-(2-Chloroethyl)-N'-[2-(2-pyridinyl)ethyl]urea
• CAS No.: 42471-42-1
• Molecular Formula: C₁₀H₁₄ClN₃O
• Molecular Weight: 227.694
• Hs Code.: 2933399090
• DSSTox Substance ID: DTXSID40522296
• Wikidata: Q82387443
• Mol file: 42471-42-1.mol

Synonyms:42471-42-1;N-(2-Chloroethyl)-N'-[2-(2-pyridinyl)ethyl]urea;1-(2-chloroethyl)-3-(2-pyridin-2-ylethyl)urea;1-(2-Chloroethyl)-3-(2-(pyridin-2-yl)ethyl)urea;3-(2-chloroethyl)-1-[2-(pyridin-2-yl)ethyl]urea;Urea,N-(2-chloroethyl)-N'-[2-(2-pyridinyl)ethyl]-;SCHEMBL11701162;DTXSID40522296;MFCD08689733;AKOS005072750;FA-0886;CS-0332336;J-502979;N-(2-Chloroethyl)-N'-[2-(pyridin-2-yl)ethyl]urea;Carbamic?acid,?[2-oxo-1-(phenylmethyl)-2-(1-pyrrolidinyl)ethyl]-,?1,1-dimethylethyl?ester,?(S)-

Chemical Property of N-(2-Chloroethyl)-N'-[2-(2-pyridinyl)ethyl]urea

Chemical Property:

• Vapor Pressure: 4.13E-08mmHg at 25°C
• Melting Point: 112-114 °C
• Refractive Index: 1.538
• Boiling Point: 444.9 °C at 760 mmHg
• Flash Point: 222.9 °C
• PSA: 54.02000
• Density: 1.191 g/cm³
• LogP: 1.94390
• XLogP3: 0.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 227.0825398
• Heavy Atom Count: 15
• Complexity: 190

Purity/Quality:

98%min ^*data from raw suppliers

N-(2-Chloroethyl)-N''-[2-(2-pyridinyl)ethyl]urea ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=NC(=C1)CCNC(=O)NCCCl