ChemSpider 2D Image | 3-(3,4-Dichlorobenzyl)-4-oxo-4H-pyrido[1,2-a]pyrimidine-7-carboxylic acid | C16H10Cl2N2O3

3-(3,4-Dichlorobenzyl)-4-oxo-4H-pyrido[1,2-a]pyrimidine-7-carboxylic acid

  • Molecular FormulaC16H10Cl2N2O3
  • Average mass349.168 Da
  • Monoisotopic mass348.006836 Da
  • ChemSpider ID21864396

More details:

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

1089342-78-8 [RN]
3-(3,4-Dichlorbenzyl)-4-oxo-4H-pyrido[1,2-a]pyrimidin-7-carbonsäure [German] [ACD/IUPAC Name]
3-(3,4-Dichlorobenzyl)-4-oxo-4H-pyrido[1,2-a]pyrimidine-7-carboxylic acid [ACD/IUPAC Name]
3-[(3,4-dichlorophenyl)methyl]-4-oxo-4H-pyrido[1,2-a]pyrimidine-7-carboxylic acid
3-[(3,4-dichlorophenyl)methyl]-4-oxopyrido[1,2-a]pyrimidine-7-carboxylic acid
4H-Pyrido[1,2-a]pyrimidine-7-carboxylic acid, 3-[(3,4-dichlorophenyl)methyl]-4-oxo- [ACD/Index Name]
Acide 3-(3,4-dichlorobenzyl)-4-oxo-4H-pyrido[1,2-a]pyrimidine-7-carboxylique [French] [ACD/IUPAC Name]
3-(3,4-Dichlorobenzyl)-4-oxo-4H-pyrido[1,2-a]-pyrimidine-7-carboxylic acid

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

MFCD11853611 [DBID]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 507.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.8±3.0 kJ/mol
Flash Point: 260.5±32.9 °C
Index of Refraction: 1.683
Molar Refractivity: 87.4±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.36
ACD/LogD (pH 5.5): 2.56
ACD/BCF (pH 5.5): 44.25
ACD/KOC (pH 5.5): 435.32
ACD/LogD (pH 7.4): 1.00
ACD/BCF (pH 7.4): 1.22
ACD/KOC (pH 7.4): 12.02
Polar Surface Area: 70 Å2
Polarizability: 34.6±0.5 10-24cm3
Surface Tension: 58.0±7.0 dyne/cm
Molar Volume: 230.6±7.0 cm3

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