Product Name

  • Name

    BENZYL-(4-CHLORO-BENZYL)-AMINE

  • EINECS
  • CAS No. 13541-00-9
  • Article Data36
  • CAS DataBase
  • Density 1.137 g/cm3
  • Solubility
  • Melting Point
  • Formula C14H14ClN
  • Boiling Point 334.1 °C at 760 mmHg
  • Molecular Weight 231.725
  • Flash Point 155.9 °C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes  Xi:;
  • Molecular Structure Molecular Structure of 13541-00-9 (BENZYL-(4-CHLORO-BENZYL)-AMINE)
  • Hazard Symbols IrritantXi
  • Synonyms Dibenzylamine, 4-chloro- (6CI,8CI);4-Chlorodibenzylamine;Benzyl(4-chlorobenzyl)amine;N-Benzyl-N-(4-chlorobenzyl)amine;
  • PSA 12.03000
  • LogP 4.02070

Benzenemethanamine, 4-chloro-N-(phenylmethyl)- Specification

The CAS register number of Benzenemethanamine, 4-chloro-N-(phenylmethyl)- is 13541-00-9. It also can be called as Benzyl(4-chlorobenzyl)amine and the IUPAC name about this chemical is N-[(4-chlorophenyl)methyl]-1-phenylmethanamine. The molecular formula about this chemical is C14H14ClN and the molecular weight is 231.72. This chemical is irritant and it may cause inflammation to the skin or other mucous membranes.

Physical properties about Benzenemethanamine, 4-chloro-N-(phenylmethyl)- are: (1)ACD/LogP: 4.02; (2)#H bond acceptors: 1; (3)#H bond donors: 1; (4)#Freely Rotating Bonds: 4; (5)Polar Surface Area: 3.24 Å2; (6)Index of Refraction: 1.59; (7)Molar Refractivity: 68.77 cm3; (8)Molar Volume: 203.7 cm3; (9)Polarizability: 27.26x10-24cm3; (10)Surface Tension: 42.4 dyne/cm; (11)Density: 1.137 g/cm3; (12)Flash Point: 155.9 °C; (13)Enthalpy of Vaporization: 57.7 kJ/mol; (14)Boiling Point: 334.1 °C at 760 mmHg; (15)Vapour Pressure: 0.000131 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1ccc(cc1)CNCc2ccccc2
(2)InChI: InChI=1/C14H14ClN/c15-14-8-6-13(7-9-14)11-16-10-12-4-2-1-3-5-12/h1-9,16H,10-11H2
(3)InChIKey: NLJKKSSMEUWPKM-UHFFFAOYAV
(4)Std. InChI: InChI=1S/C14H14ClN/c15-14-8-6-13(7-9-14)11-16-10-12-4-2-1-3-5-12/h1-9,16H,10-11H2
(5)Std. InChIKey: NLJKKSSMEUWPKM-UHFFFAOYSA-N

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