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Urea,N-(2-chloroethyl)-N'-(4-methoxyphenyl)-

  • Name Urea,N-(2-chloroethyl)-N'-(4-methoxyphenyl)-
  • EINECSN/A
  • CAS No. 65536-40-5
  • Density1.248 g/cm3
  • PSA50.36000
  • LogP2.51940
  • SolubilityN/A
  • Melting Point156-158 °C
  • FormulaC10H13ClN2O2
  • Boiling Point338.9 °C at 760 mmHg
  • Molecular Weight228.678
  • Flash Point158.8 °C
  • Transport InformationN/A
  • AppearanceN/A
  • Safety
  • Risk CodesN/A
  • Molecular Structure
    Molecular Structure of 65536-40-5 (N-(2-CHLOROETHYL)-N'-(4-METHOXYPHENYL)UREA)
  • Hazard SymbolsIrritantXi
  • SynonymsIrritantXi
  • Article Data4

Urea,N-(2-chloroethyl)-N'-(4-methoxyphenyl)- Specification

The Urea,N-(2-chloroethyl)-N'-(4-methoxyphenyl)-, with the CAS registry number 65536-40-5, is also known as N-(2-Chloroethyl)-N'-(4-methoxyphenyl)urea. This chemical's molecular formula is C10H13ClN2O2 and molecular weight is 228.67542. Its systematic name is called 1-(2-chloroethyl)-3-(4-methoxyphenyl)urea. When you are using this chemical, please be cautious about it. This chemical may cause inflammation to the skin or other mucous membranes.

Physical properties of Urea,N-(2-chloroethyl)-N'-(4-methoxyphenyl)-: (1)ACD/LogP: 1.35; (2)ACD/LogD (pH 5.5): 1.35; (3)ACD/LogD (pH 7.4): 1.35; (4)ACD/BCF (pH 5.5): 6.24; (5)ACD/BCF (pH 7.4): 6.24; (6)ACD/KOC (pH 5.5): 129.02; (7)ACD/KOC (pH 7.4): 129.01; (8)#H bond acceptors: 4; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 4; (11)Index of Refraction: 1.571; (12)Molar Refractivity: 60.28 cm3; (13)Molar Volume: 183.2 cm3; (14)Surface Tension: 44.7 dyne/cm; (15)Density: 1.248 g/cm3; (16)Flash Point: 158.8 °C; (17)Enthalpy of Vaporization: 58.23 kJ/mol; (18)Boiling Point: 338.9 °C at 760 mmHg; (19)Vapour Pressure: 9.53E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: ClCCNC(=O)Nc1ccc(OC)cc1
(2)InChI: InChI=1/C10H13ClN2O2/c1-15-9-4-2-8(3-5-9)13-10(14)12-7-6-11/h2-5H,6-7H2,1H3,(H2,12,13,14)
(3)InChIKey: CNYYWOOAIIXDLZ-UHFFFAOYAS

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