ChemSpider 2D Image | 3-Benzyloxycarbonyl-4-benzyloxy-benzoic acid | C22H18O5

3-Benzyloxycarbonyl-4-benzyloxy-benzoic acid

  • Molecular FormulaC22H18O5
  • Average mass362.375 Da
  • Monoisotopic mass362.115417 Da
  • ChemSpider ID21112165

More details:

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

1,3-Benzenedicarboxylic acid, 4-(phenylmethoxy)-, 3-(phenylmethyl) ester [ACD/Index Name]
3-Benzyloxycarbonyl-4-benzyloxy-benzoic acid
4-(Benzyloxy)-3-[(benzyloxy)carbonyl]benzoesäure [German] [ACD/IUPAC Name]
4-(Benzyloxy)-3-[(benzyloxy)carbonyl]benzoic acid [ACD/IUPAC Name]
Acide 4-(benzyloxy)-3-[(benzyloxy)carbonyl]benzoïque [French] [ACD/IUPAC Name]
3-benzyloxycarbonyl-4-benzyloxybenzoic acid
3-BENZYLOXYCARBONYL-4-BENZYLOXY-BENZOICACID
4-(Benzyloxy)-3-((benzyloxy)carbonyl)benzoic acid
4-(Phenylmethoxy)-1,3-benzenedicarboxylic acid 3-(phenylmethyl)ester
433736-14-2 [RN]
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 563.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 89.1±3.0 kJ/mol
Flash Point: 199.4±22.2 °C
Index of Refraction: 1.623
Molar Refractivity: 100.6±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 5.25
ACD/LogD (pH 5.5): 3.73
ACD/BCF (pH 5.5): 183.52
ACD/KOC (pH 5.5): 576.82
ACD/LogD (pH 7.4): 2.22
ACD/BCF (pH 7.4): 5.70
ACD/KOC (pH 7.4): 17.92
Polar Surface Area: 73 Å2
Polarizability: 39.9±0.5 10-24cm3
Surface Tension: 54.5±3.0 dyne/cm
Molar Volume: 285.3±3.0 cm3

Click to predict properties on the Chemicalize site


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