Product Name

  • Name

    2,4-DICHLORO-5,7-DIHYDROFURO[3,4-D]PYRIMIDINE

  • EINECS
  • CAS No. 848398-41-4
  • Article Data3
  • CAS DataBase
  • Density 1.593 g/cm3
  • Solubility
  • Melting Point
  • Formula C6H4Cl2N2O
  • Boiling Point 337.837 °C at 760 mmHg
  • Molecular Weight 191.017
  • Flash Point 158.118 °C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 848398-41-4 (2,4-DICHLORO-5,7-DIHYDROFURO[3,4-D]PYRIMIDINE)
  • Hazard Symbols
  • Synonyms 2,4-DICHLORO-5,7-DIHYDROFURO[3,4-D]PYRIMIDINE; Furo[3,4-d]pyrimidine, 2,4-dichloro-5,7-dihydro-
  • PSA 35.01000
  • LogP 1.81360

2,4-Dichloro-5,7-dihydrofuro[3,4-d]pyrimidine Specification

The CAS registry number of Furo[3,4-d]pyrimidine, 2,4-dichloro-5,7-dihydro- is 848398-41-4. This chemical's molecular formula is C6H4Cl2N2O and molecular weight is 191.01. What's more, both its IUPAC name and systematic name are the same which is called 2,4-Dichloro-5,7-dihydrofuro[3,4-d]pyrimidine.

Physical properties about Furo[3,4-d]pyrimidine, 2,4-dichloro-5,7-dihydro- are: (1)ACD/LogP: 0.782; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.78; (4)ACD/LogD (pH 7.4): 0.78; (5)ACD/BCF (pH 5.5): 2.31; (6)ACD/BCF (pH 7.4): 2.31; (7)ACD/KOC (pH 5.5): 63.44; (8)ACD/KOC (pH 7.4): 63.44; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 35.01 Å2; (13)Index of Refraction: 1.606 ; (14)Molar Refractivity: 41.393 cm3; (15)Molar Volume: 119.917 cm3; (16)Polarizability: 16.41×10-24cm3; (17)Surface Tension: 63.189 dyne/cm; (18)Density: 1.593 g/cm3; (19)Flash Point: 158.118 °C; (20)Enthalpy of Vaporization: 55.811 kJ/mol; (21)Boiling Point: 337.837 °C at 760 mmHg; (22) Vapour Pressure: 0 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Clc1nc(Cl)nc2COCc12
(2) InChI: InChI=1S/C6H4Cl2N2O/c7-5-3-1-11-2-4(3)9-6(8)10-5/h1-2H2
(3) InChIKey: WRAAHQVXMZLMQR-UHFFFAOYSA-N

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