ChemSpider 2D Image | (1S,3S)-1,3-Cyclopentanedicarboxylic acid | C7H10O4

(1S,3S)-1,3-Cyclopentanedicarboxylic acid

  • Molecular FormulaC7H10O4
  • Average mass158.152 Da
  • Monoisotopic mass158.057907 Da
  • ChemSpider ID24216723

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(1S,3S)-1,3-Cyclopentandicarbonsäure [German] [ACD/IUPAC Name]
(1S,3S)-1,3-Cyclopentanedicarboxylic acid [ACD/IUPAC Name]
1,3-Cyclopentanedicarboxylic acid, (1S,3S)- [ACD/Index Name]
Acide (1S,3S)-1,3-cyclopentanedicarboxylique [French] [ACD/IUPAC Name]
(1R,3R)-Cyclopentane-1,3-dicarboxylic acid
(1S,3S)-cyclopentane-1,3-dicarboxylic acid
1,3-Cyclopentanedicarboxylic acid, (1S-trans)- (9CI)
36010-89-6 [RN]
826-02-8 [RN]
Cyclopentane-1,3-dicarboxylic acid [ACD/IUPAC Name]
More...

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 320.7±25.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.5 mmHg at 25°C
    Enthalpy of Vaporization: 61.8±6.0 kJ/mol
    Flash Point: 161.9±19.7 °C
    Index of Refraction: 1.535
    Molar Refractivity: 35.3±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: -0.10
    ACD/LogD (pH 5.5): -1.61
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -4.52
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 75 Å2
    Polarizability: 14.0±0.5 10-24cm3
    Surface Tension: 64.7±3.0 dyne/cm
    Molar Volume: 113.2±3.0 cm3

    Click to predict properties on the Chemicalize site


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