CAS No.663954-31-2,2-P-TERPHENYLBORONIC ACID Suppliers

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Basic Information

Molecular Structure:
CAS No.:	663954-31-2
Name:	2-P-TERPHENYLBORONIC ACID
Article Data:	2

Formula:	C₁₈H₁₅BO₂
Molecular Weight:	274.127
Synonyms:	Boronicacid, [1,1':4',1''-terphenyl]-2-yl- (9CI);
Density:	1.211 g/cm³
Boiling Point:	522.595 °C at 760 mmHg
Flash Point:	269.856 °C
PSA:	40.46000
LogP:	2.70040

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Specification

The Boronic acid,B-[1,1':4',1''-terphenyl]-2-yl-, with the CAS registry number 663954-31-2, is also known as 2-p-Terphenylboronic acid. It belongs to the product categories of B (Classes of Boron Compounds); Boronic Acids; Boronic acid series. This chemical's molecular formula is C₁₈H₁₅BO₂ and molecular weight is 274.1215. Its systematic name is called 1,1':4',1''-terphenyl-2-ylboronic acid.

Physical properties of Boronic acid,B-[1,1':4',1''-terphenyl]-2-yl-: (1)ACD/LogP: 4.57; (2)ACD/LogD (pH 5.5): 5; (3)ACD/LogD (pH 7.4): 5; (4)ACD/BCF (pH 5.5): 3739; (5)ACD/BCF (pH 7.4): 3497; (6)ACD/KOC (pH 5.5): 12556; (7)ACD/KOC (pH 7.4): 11743; (8)#H bond acceptors: 2; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 5; (11)Index of Refraction: 1.652; (12)Molar Refractivity: 82.701 cm³; (13)Molar Volume: 226.322 cm³; (14)Surface Tension: 54.815 dyne/cm; (15)Density: 1.211 g/cm³; (16)Flash Point: 269.856 °C; (17)Enthalpy of Vaporization: 83.805 kJ/mol; (18)Boiling Point: 522.595 °C at 760 mmHg; (19)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: OB(O)c3ccccc3c1ccc(cc1)c2ccccc2
(2)InChI: InChI=1/C18H15BO2/c20-19(21)18-9-5-4-8-17(18)16-12-10-15(11-13-16)14-6-2-1-3-7-14/h1-13,20-21H
(3)InChIKey: SNYOIUKSBGFPSV-UHFFFAOYAM