ChemSpider 2D Image | Methyl 7-benzyloxy-1H-indazole-3-carboxylate | C16H14N2O3

Methyl 7-benzyloxy-1H-indazole-3-carboxylate

  • Molecular FormulaC16H14N2O3
  • Average mass282.294 Da
  • Monoisotopic mass282.100433 Da
  • ChemSpider ID28474011

More details:

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

1H-Indazole-3-carboxylic acid, 7-(phenylmethoxy)-, methyl ester [ACD/Index Name]
7-(Benzyloxy)-1H-indazole-3-carboxylate de méthyle [French] [ACD/IUPAC Name]
885278-65-9 [RN]
Methyl 7-(benzyloxy)-1H-indazole-3-carboxylate [ACD/IUPAC Name]
Methyl 7-benzyloxy-1H-indazole-3-carboxylate
Methyl-7-(benzyloxy)-1H-indazol-3-carboxylat [German] [ACD/IUPAC Name]
[885278-65-9] [RN]
1H-INDAZOLE-3-CARBOXYLICACID, 7-(PHENYLMETHOXY)-, METHYL ESTER
'885278-65-9 [EINECS]
METHYL 7-(BENZYLOXY)-2H-INDAZOLE-3-CARBOXYLATE
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 481.9±30.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 74.7±3.0 kJ/mol
    Flash Point: 245.3±24.6 °C
    Index of Refraction: 1.652
    Molar Refractivity: 79.6±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 3.17
    ACD/LogD (pH 5.5): 3.75
    ACD/BCF (pH 5.5): 414.66
    ACD/KOC (pH 5.5): 2602.24
    ACD/LogD (pH 7.4): 3.75
    ACD/BCF (pH 7.4): 414.58
    ACD/KOC (pH 7.4): 2601.73
    Polar Surface Area: 64 Å2
    Polarizability: 31.5±0.5 10-24cm3
    Surface Tension: 57.1±3.0 dyne/cm
    Molar Volume: 217.7±3.0 cm3

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