ChemSpider 2D Image | Dimethyl 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)isophthalate | C16H21BO6

Dimethyl 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)isophthalate

  • Molecular FormulaC16H21BO6
  • Average mass320.145 Da
  • Monoisotopic mass320.143127 Da
  • ChemSpider ID26327980

More details:

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

1,3-Benzenedicarboxylic acid, 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, dimethyl ester [ACD/Index Name]
5-(4,4,5,5-Tétraméthyl-1,3,2-dioxaborolan-2-yl)isophtalate de diméthyle [French] [ACD/IUPAC Name]
944392-68-1 [RN]
Dimethyl 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)isophthalate [ACD/IUPAC Name]
Dimethyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)isophthalat [German] [ACD/IUPAC Name]
1,3-dimethyl 5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzene-1,3-dicarboxylate
177735-55-6 [RN]
3,5-bis(methoxycarbonyl)phenylboronic acid
3,5-Bis(methoxycarbonyl)phenylboronic acid pinacol ester
3,5-Dimethy(benzenecarboxylate)-5-boronic acid pinacol ester
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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: 435.4±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.2±3.0 kJ/mol
Flash Point: 217.1±25.9 °C
Index of Refraction: 1.504
Molar Refractivity: 81.7±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 5
#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: 71 Å2
Polarizability: 32.4±0.5 10-24cm3
Surface Tension: 39.1±5.0 dyne/cm
Molar Volume: 275.7±5.0 cm3

Click to predict properties on the Chemicalize site


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