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Basic Information
CAS No.: 334658-75-2
Name: (10-Phenylanthracen-9-yl)boronic acid
Article Data: 26
Molecular Structure:
Molecular Structure of 334658-75-2 ((10-Phenylanthracen-9-yl)boronic acid)
Formula: C20H15BO2
Molecular Weight: 298.149
Synonyms: (10-Phenyl-9-anthryl)boronic acid;10-Phenyl-9-anthracene boronic acid;
Density: 1.274 g/cm3
Boiling Point: 521.325 °C at 760 mmHg
Flash Point: 269.088 °C
PSA: 40.46000
LogP: 3.33980
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    (10-Phenylanthracen-9-yl)boronic acid

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  • (10-Phenylanthracen-9-yl)boronic acid

  • Casno:

    334658-75-2

    (10-Phenylanthracen-9-yl)boronic acid

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  • Casno:

    334658-75-2

    (10-PHENYLANTHRACEN-9-YL)BORONIC ACID

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  • Casno:

    334658-75-2

    10-Phenylanthracen-9-yl)boronic acid

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Specification

The (10-Phenylanthracen-9-yl)boronic acid, with the CAS registry number 334658-75-2, is also known as Boronic acid, B-(10-phenyl-9-anthracenyl)-. This chemical's molecular formula is C20H15BO2 and molecular weight is 298.14. Its systematic name is called (10-phenylanthracen-9-yl)boronic acid.

Physical properties of (10-Phenylanthracen-9-yl)boronic acid: (1)ACD/LogP: 5.52; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 6; (4)ACD/LogD (pH 7.4): 6; (5)ACD/BCF (pH 5.5): 15268; (6)ACD/BCF (pH 7.4): 14357; (7)ACD/KOC (pH 5.5): 34375; (8)ACD/KOC (pH 7.4): 32323; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 4; (12)Index of Refraction: 1.727; (13)Molar Refractivity: 93.109 cm3; (14)Molar Volume: 233.978 cm3; (15)Surface Tension: 60.877 dyne/cm; (16)Density: 1.274 g/cm3; (17)Flash Point: 269.088 °C; (18)Enthalpy of Vaporization: 83.642 kJ/mol; (19)Boiling Point: 521.325 °C at 760 mmHg; (20)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: OB(O)c2c4ccccc4c(c1ccccc12)c3ccccc3
(2)InChI: InChI=1/C20H15BO2/c22-21(23)20-17-12-6-4-10-15(17)19(14-8-2-1-3-9-14)16-11-5-7-13-18(16)20/h1-13,22-23H
(3)InChIKey: RVPCPPWNSMAZKR-UHFFFAOYAB