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1-Chloro-3,5-di-(4-chlorobenzoyl)-2-deoxy-D-ribose

  • Name 1-Chloro-3,5-di-(4-chlorobenzoyl)-2-deoxy-D-ribose
  • EINECS606-827-9
  • CAS No. 21740-23-8
  • Density1.46 g/cm3
  • PSA61.83000
  • LogP4.72960
  • SolubilityN/A
  • Melting Point110-118 °C (dec.)
  • FormulaC19H15Cl3O5
  • Boiling Point530.6 °C at 760 mmHg
  • Molecular Weight429.684
  • Flash Point193 °C
  • Transport InformationN/A
  • AppearanceWhite solid
  • Safety
  • Risk CodesN/A
  • Molecular Structure
    Molecular Structure of 21740-23-8 (1-Chloro-3,5-di-(4-chlorobenzoyl)-2-deoxy-D-ribose)
  • Hazard SymbolsN/A
  • SynonymsN/A
  • Article Data7

1-Chloro-3,5-di-(4-chlorobenzoyl)-2-deoxy-D-ribose Specification

The CAS register number of 1-Chloro-3,5-di-(4-chlorobenzoyl)-2-deoxy-D-ribose is 21740-23-8. It also can be called as a-D-erythro-Pentofuranosylchloride, 2-deoxy-, 3,5-bis(4-chlorobenzoate) and the IUPAC name about this chemical is [5-chloro-3-(4-chlorobenzoyl)oxyoxolan-2-yl]methyl 4-chlorobenzoate. The molecular formula about this chemical is C19H15Cl3O5 and the molecular weight is 429.68.

Physical properties about 1-Chloro-3,5-di-(4-chlorobenzoyl)-2-deoxy-D-ribose are: (1)ACD/LogP: 5.44; (2)# of Rule of 5 Violations: 1; (3)#H bond acceptors: 5; (4)#Freely Rotating Bonds: 7; (5)Polar Surface Area: 61.83Å2; (6)Index of Refraction: 1.61; (7)Molar Refractivity: 101.71 cm3; (8)Molar Volume: 293.2 cm3; (9)Polarizability: 40.32x10-24cm3; (10)Surface Tension: 57.3 dyne/cm; (11)Enthalpy of Vaporization: 80.6 kJ/mol; (12)Boiling Point: 530.6 °C at 760 mmHg; (13)Vapour Pressure: 2.42E-11 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(OC1C(OC(Cl)C1)COC(=O)c2ccc(Cl)cc2)c3ccc(Cl)cc3
(2)InChI: InChI=1/C19H15Cl3O5/c20-13-5-1-11(2-6-13)18(23)25-10-16-15(9-17(22)26-16)27-19(24)12-3-7-14(21)8-4-12/h1-8,15-17H,9-10H2
(3)InChIKey: QEHCZULNFYDPPL-UHFFFAOYAM
(4)Std. InChI: InChI=1S/C19H15Cl3O5/c20-13-5-1-11(2-6-13)18(23)25-10-16-15(9-17(22)26-16)27-19(24)12-3-7-14(21)8-4-12/h1-8,15-17H,9-10H2
(5)Std. InChIKey: QEHCZULNFYDPPL-UHFFFAOYSA-N

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