Found 81 results

Search term: MF = 'C_{12}H_{11}ClO_{6}'
ChemSpider 2D Image | 2-[Carboxy(hydroxy)methyl]-3-(3-chloropropanoyl)benzoic acid | C12H11ClO6

2-[Carboxy(hydroxy)methyl]-3-(3-chloropropanoyl)benzoic acid

  • Molecular FormulaC12H11ClO6
  • Average mass286.665 Da
  • Monoisotopic mass286.024414 Da
  • ChemSpider ID57405788

More details:

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

2-[Carboxy(hydroxy)methyl]-3-(3-chloropropanoyl)benzoic acid [ACD/IUPAC Name]
2-[Carboxy(hydroxy)methyl]-3-(3-chlorpropanoyl)benzoesäure [German] [ACD/IUPAC Name]
Acide 2-[carboxy(hydroxy)méthyl]-3-(3-chloropropanoyl)benzoïque [French] [ACD/IUPAC Name]
Benzeneacetic acid, 2-carboxy-6-(3-chloro-1-oxopropyl)-α-hydroxy- [ACD/Index Name]
1806661-70-0 [RN]
2-(Carboxy(hydroxy)methyl)-3-(3-chloropropanoyl)benzoic acid

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

Density: 1.5±0.1 g/cm3
Boiling Point: 593.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.0±3.0 kJ/mol
Flash Point: 312.6±30.1 °C
Index of Refraction: 1.616
Molar Refractivity: 65.3±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 0.83
ACD/LogD (pH 5.5): -3.27
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.59
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 112 Å2
Polarizability: 25.9±0.5 10-24cm3
Surface Tension: 72.9±3.0 dyne/cm
Molar Volume: 187.1±3.0 cm3

Click to predict properties on the Chemicalize site


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