ChemSpider 2D Image | (4-(Diisopropylcarbamoyl)pyridin-3-yl)boronic acid | C12H19BN2O3

(4-(Diisopropylcarbamoyl)pyridin-3-yl)boronic acid

  • Molecular FormulaC12H19BN2O3
  • Average mass250.102 Da
  • Monoisotopic mass250.148880 Da
  • ChemSpider ID28535045

More details:

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

(4-(Diisopropylcarbamoyl)pyridin-3-yl)boronic acid
[4-(Diisopropylcarbamoyl)-3-pyridinyl]boronic acid [ACD/IUPAC Name]
[4-(Diisopropylcarbamoyl)-3-pyridinyl]borsäure [German] [ACD/IUPAC Name]
868997-86-8 [RN]
Acide [4-(diisopropylcarbamoyl)-3-pyridinyl]boronique [French] [ACD/IUPAC Name]
Boronic acid, B-[4-[[bis(1-methylethyl)amino]carbonyl]-3-pyridinyl]- [ACD/Index Name]
[868997-86-8] [RN]
{4-[BIS(PROPAN-2-YL)CARBAMOYL]PYRIDIN-3-YL}BORONIC ACID
{4-[Di(propan-2-yl)carbamoyl]pyridin-3-yl}boronic acid
4-(DIISOPROPYLCARBAMOYL)PYRIDIN-3-YLBORONIC ACID
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.1±0.1 g/cm3
    Boiling Point: 459.9±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 75.9±3.0 kJ/mol
    Flash Point: 231.9±31.5 °C
    Index of Refraction: 1.527
    Molar Refractivity: 67.4±0.4 cm3
    #H bond acceptors: 5
    #H bond donors: 2
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 0.30
    ACD/LogD (pH 5.5): 0.65
    ACD/BCF (pH 5.5): 1.66
    ACD/KOC (pH 5.5): 44.58
    ACD/LogD (pH 7.4): -0.78
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.64
    Polar Surface Area: 74 Å2
    Polarizability: 26.7±0.5 10-24cm3
    Surface Tension: 46.7±5.0 dyne/cm
    Molar Volume: 219.3±5.0 cm3

    Click to predict properties on the Chemicalize site


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