ChemSpider 2D Image | 5-(3,4-Dichlorophenoxy)-1,3-benzenediol | C12H8Cl2O3

5-(3,4-Dichlorophenoxy)-1,3-benzenediol

  • Molecular FormulaC12H8Cl2O3
  • Average mass271.096 Da
  • Monoisotopic mass269.985046 Da
  • ChemSpider ID30840486

More details:






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

1,3-Benzenediol, 5-(3,4-dichlorophenoxy)- [ACD/Index Name]
5-(3,4-Dichlorophenoxy)-1,3-benzenediol [ACD/IUPAC Name]
5-(3,4-Dichlorophénoxy)-1,3-benzènediol [French] [ACD/IUPAC Name]
5-(3,4-Dichloro-Phenoxy)-Benzene-1,3-Diol
5-(3,4-Dichlorphenoxy)-1,3-benzoldiol [German] [ACD/IUPAC Name]
1379803-52-7 [RN]
50Q

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point: 421.6±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 70.2±3.0 kJ/mol
Flash Point: 208.8±25.9 °C
Index of Refraction: 1.654
Molar Refractivity: 66.3±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.30
ACD/LogD (pH 5.5): 3.76
ACD/BCF (pH 5.5): 422.15
ACD/KOC (pH 5.5): 2635.32
ACD/LogD (pH 7.4): 3.74
ACD/BCF (pH 7.4): 402.21
ACD/KOC (pH 7.4): 2510.87
Polar Surface Area: 50 Å2
Polarizability: 26.3±0.5 10-24cm3
Surface Tension: 58.6±3.0 dyne/cm
Molar Volume: 180.8±3.0 cm3

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