ChemSpider 2D Image | 3,4-Bis[(~2~H_3_)methyloxy]benzaldehyde | C9H4D6O3

3,4-Bis[(2H3)methyloxy]benzaldehyde

  • Molecular FormulaC9H4D6O3
  • Average mass172.211 Da
  • Monoisotopic mass172.100662 Da
  • ChemSpider ID34559504
  • Non-standard isotope - Non-standard isotope


More details:






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

3,4-Bis[(2H3)methyloxy]benzaldehyd [German] [ACD/IUPAC Name]
3,4-Bis[(2H3)methyloxy]benzaldehyde [ACD/IUPAC Name]
3,4-Bis[(2H3)méthyloxy]benzaldéhyde [French] [ACD/IUPAC Name]
Benzaldehyde, 3,4-bis(methyl-d3-oxy)- [ACD/Index Name]
1162658-05-0 [RN]
3,4-dimethoxybenzaldehyde-d6
3,4-Dimethoxy-d6-benzaldehyde
3,4-Dimethoxy-d6-benzaldehyde
MFCD28125399

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

Density: 1.1±0.1 g/cm3
Boiling Point: 281.0±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 52.0±3.0 kJ/mol
Flash Point: 110.4±8.2 °C
Index of Refraction: 1.534
Molar Refractivity: 46.4±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.61
ACD/LogD (pH 5.5): 1.34
ACD/BCF (pH 5.5): 6.16
ACD/KOC (pH 5.5): 127.82
ACD/LogD (pH 7.4): 1.34
ACD/BCF (pH 7.4): 6.16
ACD/KOC (pH 7.4): 127.82
Polar Surface Area: 36 Å2
Polarizability: 18.4±0.5 10-24cm3
Surface Tension: 36.2±3.0 dyne/cm
Molar Volume: 149.1±3.0 cm3

Click to predict properties on the Chemicalize site






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