ChemSpider 2D Image | DMADC | C14H20O4

DMADC

  • Molecular FormulaC14H20O4
  • Average mass252.306 Da
  • Monoisotopic mass252.136154 Da
  • ChemSpider ID22937712

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(1s,3s,5s,7s)-1,3-Adamantanedicarboxylate de diméthyle [French] [ACD/IUPAC Name]
1459-95-6 [RN]
Dimethyl (1s,3s,5s,7s)-1,3-adamantanedicarboxylate [ACD/IUPAC Name]
Dimethyl-(1s,3s,5s,7s)-1,3-adamantandicarboxylat [German] [ACD/IUPAC Name]
DMADC
MFCD00167791 [MDL number]
Tricyclo[3.3.1.13,7]decane-1,3-dicarboxylic acid, dimethyl ester [ACD/Index Name]
[1459-95-6] [RN]
1,3-dimethyl adamantane-1,3-dicarboxylate
Dimethyl adamantane-1,3-dicarboxylate
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point: 320.0±15.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 56.2±3.0 kJ/mol
Flash Point: 152.7±18.8 °C
Index of Refraction: 1.539
Molar Refractivity: 63.9±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.20
ACD/LogD (pH 5.5): 2.58
ACD/BCF (pH 5.5): 53.83
ACD/KOC (pH 5.5): 603.48
ACD/LogD (pH 7.4): 2.58
ACD/BCF (pH 7.4): 53.83
ACD/KOC (pH 7.4): 603.48
Polar Surface Area: 53 Å2
Polarizability: 25.3±0.5 10-24cm3
Surface Tension: 49.6±3.0 dyne/cm
Molar Volume: 204.2±3.0 cm3

Click to predict properties on the Chemicalize site


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