ChemSpider 2D Image | methyl 4-hydroxy-2-methyl-benzofuran-6-carboxylate | C11H10O4

methyl 4-hydroxy-2-methyl-benzofuran-6-carboxylate

  • Molecular FormulaC11H10O4
  • Average mass206.195 Da
  • Monoisotopic mass206.057907 Da
  • ChemSpider ID24597863

More details:






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

Methyl 4-hydroxy-2-methyl-1-benzofuran-6-carboxylate [ACD/IUPAC Name]
methyl 4-hydroxy-2-methyl-benzofuran-6-carboxylate
MFCD14584733 [MDL number]
[314725-17-2]
2-Methyl-4-hydroxy-6-methoxycarbonylbenzofuran
314725-17-2 [RN]
'314725-17-2
4-Hydroxy-2-methyl-6-benzofurancarboxylic acid methyl ester
4-Hydroxy-2-methyl-6-benzofurancarboxylicacidmethylester
4-Hydroxy-2-methyl-benzofuran-6-carboxylic acid methyl ester
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]
  • Experimental Physico-chemical Properties
  • Miscellaneous
    • Appearance:

      Not Available Novochemy [NC-11613] , [NC-19796]
    • Safety:

      20/21/22 Novochemy [NC-11613] , [NC-19796]
      20/21/36/37/39 Novochemy [NC-11613] , [NC-19796]
      GHS07; GHS09 Novochemy [NC-11613] , [NC-19796]
      H332; H403 Novochemy [NC-11613] , [NC-19796]
      P261; P262 Biosynth Q-103557
      P309+P311; P211; P242 Novochemy [NC-11613] , [NC-19796]
      R52/53 Novochemy [NC-11613]
      Warning Novochemy [NC-11613] , [NC-19796]
      Xn Novochemy [NC-19796]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 229.5±15.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 48.5±3.0 kJ/mol
Flash Point: 92.6±20.4 °C
Index of Refraction: 1.607
Molar Refractivity: 54.9±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.80
ACD/LogD (pH 5.5): 2.71
ACD/BCF (pH 5.5): 68.17
ACD/KOC (pH 5.5): 714.42
ACD/LogD (pH 7.4): 2.68
ACD/BCF (pH 7.4): 62.59
ACD/KOC (pH 7.4): 655.99
Polar Surface Area: 60 Å2
Polarizability: 21.8±0.5 10-24cm3
Surface Tension: 50.0±3.0 dyne/cm
Molar Volume: 158.9±3.0 cm3

Click to predict properties on the Chemicalize site






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