ChemSpider 2D Image | Methyl 2-benzyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)propanoate | C17H25BO4

Methyl 2-benzyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)propanoate

  • Molecular FormulaC17H25BO4
  • Average mass304.189 Da
  • Monoisotopic mass304.184601 Da
  • ChemSpider ID24777661

More details:

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

1,3,2-Dioxaborolane-2-propanoic acid, 4,4,5,5-tetramethyl-α-(phenylmethyl)-, methyl ester [ACD/Index Name]
2-Benzyl-3-(4,4,5,5-tétraméthyl-1,3,2-dioxaborolan-2-yl)propanoate de méthyle [French] [ACD/IUPAC Name]
Methyl 2-benzyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)propanoate [ACD/IUPAC Name]
Methyl-2-benzyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)propanoat [German] [ACD/IUPAC Name]
1243540-13-7 [RN]
2-Benzyl-3-methoxy-3-oxopropylboronic acid Pinacol Ester
MFCD20327976 [MDL number]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 374.6±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 62.2±3.0 kJ/mol
Flash Point: 180.3±25.9 °C
Index of Refraction: 1.493
Molar Refractivity: 84.4±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 45 Å2
Polarizability: 33.5±0.5 10-24cm3
Surface Tension: 34.8±5.0 dyne/cm
Molar Volume: 290.5±5.0 cm3

Click to predict properties on the Chemicalize site


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