ChemSpider 2D Image | (4-methyl-3-(3-(4-methylpiperidin-1-yl)propoxy)phenyl)boronic acid | C16H26BNO3

(4-methyl-3-(3-(4-methylpiperidin-1-yl)propoxy)phenyl)boronic acid

  • Molecular FormulaC16H26BNO3
  • Average mass291.194 Da
  • Monoisotopic mass291.200562 Da
  • ChemSpider ID32076275

More details:

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

(4-methyl-3-(3-(4-methylpiperidin-1-yl)propoxy)phenyl)boronic acid
{4-Methyl-3-[3-(4-methyl-1-piperidinyl)propoxy]phenyl}boronic acid [ACD/IUPAC Name]
{4-Methyl-3-[3-(4-methyl-1-piperidinyl)propoxy]phenyl}borsäure [German] [ACD/IUPAC Name]
1704064-30-1 [RN]
Acide {4-méthyl-3-[3-(4-méthyl-1-pipéridinyl)propoxy]phényl}boronique [French] [ACD/IUPAC Name]
Boronic acid, B-[4-methyl-3-[3-(4-methyl-1-piperidinyl)propoxy]phenyl]- [ACD/Index Name]
{4-METHYL-3-[3-(4-METHYLPIPERIDIN-1-YL)PROPOXY]PHENYL}BORONIC ACID
1704063-72-8 [RN]
4-methyl-3-(3-(4-methylpiperidin-1-yl)propoxy)phenylboronic acid
4-METHYL-3-[3-(4-METHYLPIPERIDIN-1-YL)PROPOXY]PHENYLBORONIC ACID
More...

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 466.6±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 76.7±3.0 kJ/mol
    Flash Point: 236.0±31.5 °C
    Index of Refraction: 1.541
    Molar Refractivity: 83.1±0.4 cm3
    #H bond acceptors: 4
    #H bond donors: 2
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 3.90
    ACD/LogD (pH 5.5): 0.33
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.45
    ACD/LogD (pH 7.4): 1.13
    ACD/BCF (pH 7.4): 1.22
    ACD/KOC (pH 7.4): 9.09
    Polar Surface Area: 53 Å2
    Polarizability: 33.0±0.5 10-24cm3
    Surface Tension: 44.7±5.0 dyne/cm
    Molar Volume: 264.5±5.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement