Product Name

  • Name

    1-chloro-2,3-dimethyl-4-(1-phenylethyl)benzene

  • EINECS
  • CAS No. 95719-24-7
  • Density 1.061g/cm3
  • Solubility
  • Melting Point
  • Formula C16H17Cl
  • Boiling Point 341.2°C at 760 mmHg
  • Molecular Weight 244.78
  • Flash Point 144.6°C
  • Transport Information
  • Appearance
  • Safety Moderately toxic by ingestion. Experimental reproductive effects. When heated to decomposition it emits toxic vapors of Cl−.
  • Risk Codes
  • Molecular Structure Molecular Structure of 95719-24-7 (1-chloro-2,3-dimethyl-4-(1-phenylethyl)benzene)
  • Hazard Symbols
  • Synonyms Chlorodimethyl(1-phenylethyl)benzene;Benzene,chlorodimethyl(1-phenylethyl);Monochlorophenylxylylethane;1,1-Phenylmonochloroxylylethane;
  • PSA 0.00000
  • LogP 5.10860

Monochlorophenylxylylethane Chemical Properties

Molecule structure of Monochlorophenylxylylethane (CAS NO.95719-24-7):

IUPAC Name: 1-Chloro-2,3-dimethyl-4-(1-phenylethyl)benzene 
Molecular Weight: 244.75918 g/mol
Molecular Formula: C16H17Cl 
Density: 1.061 g/cm3 
Boiling Point: 341.2 °C at 760 mmHg 
Flash Point: 144.6 °C
Index of Refraction: 1.561
Molar Refractivity: 74.74 cm3
Molar Volume: 230.5 cm3
Polarizability: 29.63×10-24 cm3
Surface Tension: 36.7 dyne/cm 
Enthalpy of Vaporization: 56.17 kJ/mol
Vapour Pressure: 0.000161 mmHg at 25 °C
XLogP3-AA: 5.5
Rotatable Bond Count: 2
Exact Mass: 244.101878
MonoIsotopic Mass: 244.101878
Heavy Atom Count: 17
Complexity: 232
Canonical SMILES: CC1=C(C=CC(=C1C)Cl)C(C)C2=CC=CC=C2
InChI: InChI=1S/C16H17Cl/c1-11-12(2)16(17)10-9-15(11)13(3)14-7-5-4-6-8-14/h4-10,13H,1-3H3
InChIKey of Monochlorophenylxylylethane (CAS NO.95719-24-7): JVZOSCNIJORZIZ-UHFFFAOYSA-N

Monochlorophenylxylylethane Toxicity Data With Reference

1.    

orl-rat LD50:2129 mg/kg

     GISAAA    Gigiena i Sanitariya. 58 (1)(1993),30.
2.    

orl-mus LD50:1488 mg/kg

     GISAAA    Gigiena i Sanitariya. 58 (1)(1993),30.

Monochlorophenylxylylethane Safety Profile

Moderately toxic by ingestion. Experimental reproductive effects. When heated to decomposition it emits toxic vapors of Cl−.

Monochlorophenylxylylethane Specification

 Monochlorophenylxylylethane (CAS NO.95719-24-7) is also named as 1,1-Phenylmonochloroxylylethane ; Chlorodimethyl(1-phenylethyl)benzene ; Xylene, chloro(alpha-methylbenzyl)- ; Benzene, chlorodimethyl(1-phenylethyl)- .

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