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3-Chloro-4-(4-methylpiperazin-1-yl)aniline

  • Name 3-Chloro-4-(4-methylpiperazin-1-yl)aniline
  • EINECSN/A
  • CAS No. 16154-72-6
  • Density1.207 g/cm3
  • PSA32.50000
  • LogP2.25810
  • SolubilityN/A
  • Melting Point141 °C
  • FormulaC11H16ClN3
  • Boiling Point382.135 °C at 760 mmHg
  • Molecular Weight225.721
  • Flash Point184.909 °C
  • Transport InformationN/A
  • AppearanceKind of white to yellow powder
  • Safety
  • Risk Codes Xi:;
  • Molecular Structure
    Molecular Structure of 16154-72-6 (3-CHLORO-4-(4-METHYLPIPERAZIN-1-YL)ANILINE)
  • Hazard SymbolsIrritantXi
  • SynonymsIrritantXi
  • Article Data7

3-Chloro-4-(4-methylpiperazin-1-yl)aniline Specification

The Benzenamine,3-chloro-4-(4-methyl-1-piperazinyl)- is an organic compound with the formula C11H16ClN3. The IUPAC name of this chemical is 3-Chloro-4-(4-methylpiperazin-1-yl)aniline. With the CAS registry number 16154-72-6, it is also named as 3-Chloro-4-(4-methylpiperazin-1-yl)benzenamine. The product's category is Miscellaneous. Besides, its molecular weight is 225.72.

Physical properties about Benzenamine,3-chloro-4-(4-methyl-1-piperazinyl)- are: (1)ACD/LogP: 1.76; (2)#H bond acceptors: 3; (3)#H bond donors: 2; (4)#Freely Rotating Bonds: 2; (5)Polar Surface Area: 9.72 Å2; (6)Index of Refraction: 1.598; (7)Molar Refractivity: 63.86 cm3; (8)Molar Volume: 186.9 cm3; (9)Polarizability: 25.31×10-24 cm3; (10)Surface Tension: 48 dyne/cm; (11)Density: 1.207 g/cm3; (12)Flash Point: 184.9 °C; (13)Enthalpy of Vaporization: 63.05 kJ/mol; (14)Boiling Point: 382.1 °C at 760 mmHg; (15)Vapour Pressure: 4.83E-06 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C11H16ClN3/c1-14-4-6-15(7-5-14)11-3-2-9(13)8-10(11)12/h2-3,8H,4-7,13H2,1H3
(2)InChIKey: LOCKPKWGFIBYLB-UHFFFAOYAJ
(3)Std. InChI: InChI=1S/C11H16ClN3/c1-14-4-6-15(7-5-14)11-3-2-9(13)8-10(11)12/h2-3,8H,4-7,13H2,1H3
(4)Std. InChIKey: LOCKPKWGFIBYLB-UHFFFAOYSA-N

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