ChemSpider 2D Image | [2-(Methoxycarbonyl)-3-pyridinyl]acetic acid | C9H9NO4

[2-(Methoxycarbonyl)-3-pyridinyl]acetic acid

  • Molecular FormulaC9H9NO4
  • Average mass195.172 Da
  • Monoisotopic mass195.053162 Da
  • ChemSpider ID57437653

More details:

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

[2-(Methoxycarbonyl)-3-pyridinyl]acetic acid [ACD/IUPAC Name]
[2-(Methoxycarbonyl)-3-pyridinyl]essigsäure [German] [ACD/IUPAC Name]
3-Pyridineacetic acid, 2-(methoxycarbonyl)- [ACD/Index Name]
Acide [2-(méthoxycarbonyl)-3-pyridinyl]acétique [French] [ACD/IUPAC Name]
89353-64-0 [RN]
HOMOQUINOLINIC ACID 2-METHYL ESTER
Homoquinolinic acid, 2-methyl ester

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

Density: 1.3±0.1 g/cm3
Boiling Point: 410.6±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.9±3.0 kJ/mol
Flash Point: 202.1±25.9 °C
Index of Refraction: 1.551
Molar Refractivity: 47.2±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.21
ACD/LogD (pH 5.5): -0.99
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.37
ACD/LogD (pH 7.4): -2.71
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 76 Å2
Polarizability: 18.7±0.5 10-24cm3
Surface Tension: 55.9±3.0 dyne/cm
Molar Volume: 148.0±3.0 cm3

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