ChemSpider 2D Image | 6-Benzyl 4-ethyl 2-chloro-7,8-dihydropyrido[4,3-d]pyrimidine-4,6(5H)-dicarboxylate | C18H18ClN3O4

6-Benzyl 4-ethyl 2-chloro-7,8-dihydropyrido[4,3-d]pyrimidine-4,6(5H)-dicarboxylate

  • Molecular FormulaC18H18ClN3O4
  • Average mass375.806 Da
  • Monoisotopic mass375.098572 Da
  • ChemSpider ID29358361

More details:

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

1350300-89-8 [RN]
2-Chloro-7,8-dihydropyrido[4,3-d]pyrimidine-4,6(5H)-dicarboxylate de 6-benzyle et de 4-éthyle [French] [ACD/IUPAC Name]
6-Benzyl 4-ethyl 2-chloro-7,8-dihydropyrido[4,3-d]pyrimidine-4,6(5H)-dicarboxylate [ACD/IUPAC Name]
6-Benzyl-4-ethyl-2-chlor-7,8-dihydropyrido[4,3-d]pyrimidin-4,6(5H)-dicarboxylat [German] [ACD/IUPAC Name]
Pyrido[4,3-d]pyrimidine-4,6(5H)-dicarboxylic acid, 2-chloro-7,8-dihydro-, 4-ethyl 6-(phenylmethyl) ester [ACD/Index Name]
MFCD22690151

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

Density: 1.4±0.1 g/cm3
Boiling Point: 590.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.0±3.0 kJ/mol
Flash Point: 310.6±30.1 °C
Index of Refraction: 1.597
Molar Refractivity: 94.9±0.3 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.34
ACD/LogD (pH 5.5): 3.18
ACD/BCF (pH 5.5): 154.82
ACD/KOC (pH 5.5): 1285.55
ACD/LogD (pH 7.4): 3.18
ACD/BCF (pH 7.4): 154.82
ACD/KOC (pH 7.4): 1285.55
Polar Surface Area: 82 Å2
Polarizability: 37.6±0.5 10-24cm3
Surface Tension: 58.6±3.0 dyne/cm
Molar Volume: 278.4±3.0 cm3

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