ChemSpider 2D Image | 2-O-Methylascorbic acid | C7H10O6

2-O-Methylascorbic acid

  • Molecular FormulaC7H10O6
  • Average mass190.151 Da
  • Monoisotopic mass190.047745 Da
  • ChemSpider ID24688154

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(5R)-5-[(1S)-1,2-Dihydroxyethyl]-4-hydroxy-3-methoxy-2(5H)-furanon [German] [ACD/IUPAC Name]
(5R)-5-[(1S)-1,2-Dihydroxyethyl]-4-hydroxy-3-methoxy-2(5H)-furanone [ACD/IUPAC Name]
(5R)-5-[(1S)-1,2-Dihydroxyéthyl]-4-hydroxy-3-méthoxy-2(5H)-furanone [French] [ACD/IUPAC Name]
17860-87-6 [RN]
2-O-Methylascorbic acid
2-O-methyl-l-ascorbic acid
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL452673/

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

OE7EI0514F [DBID]
UNII:OE7EI0514F [DBID]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 516.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 90.8±6.0 kJ/mol
Flash Point: 218.8±23.6 °C
Index of Refraction: 1.566
Molar Refractivity: 40.0±0.4 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -2.25
ACD/LogD (pH 5.5): -3.06
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.70
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 96 Å2
Polarizability: 15.9±0.5 10-24cm3
Surface Tension: 69.1±5.0 dyne/cm
Molar Volume: 122.7±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement