Product Name

  • Name

    3-Chloro-2,4,5,6-tetrafluorobenzylalcohol

  • EINECS
  • CAS No. 67640-29-3
  • Density 1.624 g/cm3
  • Solubility
  • Melting Point
  • Formula C7H3ClF4O
  • Boiling Point 215.8 °C at 760 mmHg
  • Molecular Weight 214.547
  • Flash Point 84.3 °C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 67640-29-3 (3-Chloro-2,4,5,6-tetrafluorobenzylalcohol)
  • Hazard Symbols
  • Synonyms 3-Chloro-2,4,5,6-tetrafluorobenzylalcohol;
  • PSA 20.23000
  • LogP 2.38870

3-Chloro-2,4,5,6-tetrafluorobenzylalcohol Specification

The Benzenemethanol,3-chloro-2,4,5,6-tetrafluoro-, with the CAS registry number 67640-29-3, is also known as 3-Chloro-2,4,5,6-tetrafluorobenzylalcohol. This chemical's molecular formula is C7H3ClF4O and molecular weight is 213.98. What's more, both its IUPAC name and systematic name are the same which is called (3-Chloro-2,4,5,6-tetrafluorophenyl)methanol.

Physical properties about Benzenemethanol,3-chloro-2,4,5,6-tetrafluoro- are: (1)ACD/LogP: 1.56; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.56; (4)ACD/LogD (pH 7.4): 1.56; (5)ACD/BCF (pH 5.5): 9.1; (6)ACD/BCF (pH 7.4): 9.1; (7)ACD/KOC (pH 5.5): 169.04; (8)ACD/KOC (pH 7.4): 169.04; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 20.23 Å2; (13)Index of Refraction: 1.48; (14)Molar Refractivity: 37.57 cm3; (15)Molar Volume: 132 cm3; (16)Surface Tension: 36.7 dyne/cm; (17)Density: 1.624 g/cm3; (18)Flash Point: 84.3 °C; (19)Enthalpy of Vaporization: 47.79 kJ/mol; (20)Boiling Point: 215.8 °C at 760 mmHg; (21)Vapour Pressure: 0.085 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Fc1c(F)c(CO)c(F)c(Cl)c1F
(2) InChI: InChI=1S/C7H3ClF4O/c8-3-4(9)2(1-13)5(10)7(12)6(3)11/h13H,1H2
(3) InChIKey: NVCPZBVRLBQWDL-UHFFFAOYSA-N

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