ChemSpider 2D Image | (3-(Dibenzo[b,d]thiophen-4-yl)phenyl)boronic acid | C18H13BO2S

(3-(Dibenzo[b,d]thiophen-4-yl)phenyl)boronic acid

  • Molecular FormulaC18H13BO2S
  • Average mass304.171 Da
  • Monoisotopic mass304.072937 Da
  • ChemSpider ID28539073

More details:

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

(3-(Dibenzo[b,d]thiophen-4-yl)phenyl)boronic acid
[3-(Dibenzo[b,d]thiophen-4-yl)phenyl]boronic acid [ACD/IUPAC Name]
[3-(Dibenzo[b,d]thiophen-4-yl)phenyl]borsäure [German] [ACD/IUPAC Name]
1307859-67-1 [RN]
Acide [3-(dibenzo[b,d]thiophén-4-yl)phényl]boronique [French] [ACD/IUPAC Name]
Boronic acid, B-[3-(dibenzo[b,d]thien-4-yl)phenyl]- [ACD/Index Name]
(3-Dibenzothiophen-4-ylphenyl)boronic acid
[1307859-67-1] [RN]
3-(4?-Dibenzothiophene) phenylboronic acid
3-(4-Dibenzo[b,d]thienyl)phenylboronic acid
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

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

Density: 1.4±0.1 g/cm3
Boiling Point: 586.0±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 92.1±3.0 kJ/mol
Flash Point: 308.2±30.7 °C
Index of Refraction: 1.749
Molar Refractivity: 91.3±0.4 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 5.51
ACD/LogD (pH 5.5): 4.97
ACD/BCF (pH 5.5): 3512.33
ACD/KOC (pH 5.5): 12003.74
ACD/LogD (pH 7.4): 4.91
ACD/BCF (pH 7.4): 3089.85
ACD/KOC (pH 7.4): 10559.84
Polar Surface Area: 69 Å2
Polarizability: 36.2±0.5 10-24cm3
Surface Tension: 65.7±5.0 dyne/cm
Molar Volume: 224.2±5.0 cm3

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