Found 118 results

Search term: MF = 'C_{7}H_{6}Cl_{2}N_{4}'
ChemSpider 2D Image | 4-Chloro-6-(chloromethyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidine | C7H6Cl2N4

4-Chloro-6-(chloromethyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidine

  • Molecular FormulaC7H6Cl2N4
  • Average mass217.055 Da
  • Monoisotopic mass215.996948 Da
  • ChemSpider ID28534907

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1H-Pyrazolo[3,4-d]pyrimidine, 4-chloro-6-(chloromethyl)-3-methyl- [ACD/Index Name]
4-Chlor-6-(chlormethyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidin [German] [ACD/IUPAC Name]
4-Chloro-6-(chloromethyl)-3-methyl-1H-pyrazolo[3,4-d]pyrimidine [ACD/IUPAC Name]
4-Chloro-6-(chlorométhyl)-3-méthyl-1H-pyrazolo[3,4-d]pyrimidine [French] [ACD/IUPAC Name]
1211585-29-3 [RN]
4-Chloro-6-(chloromethyl)-3-methyl-2H-pyrazolo[3,4-d]pyrimidine
MFCD16249850 [MDL number]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.686
Molar Refractivity: 52.3±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.91
ACD/LogD (pH 5.5): 1.26
ACD/BCF (pH 5.5): 5.37
ACD/KOC (pH 5.5): 115.87
ACD/LogD (pH 7.4): 1.24
ACD/BCF (pH 7.4): 5.13
ACD/KOC (pH 7.4): 110.72
Polar Surface Area: 54 Å2
Polarizability: 20.7±0.5 10-24cm3
Surface Tension: 73.1±3.0 dyne/cm
Molar Volume: 137.5±3.0 cm3

Click to predict properties on the Chemicalize site


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