CAS No.372963-50-3,6-METHYLPYRIDINE-2-BORONIC ACID Suppliers

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Basic Information

Molecular Structure:
CAS No.:	372963-50-3
Name:	6-METHYLPYRIDINE-2-BORONIC ACID
Article Data:	2

Formula:	C₆H₈BNO₂
Molecular Weight:	136.946
Synonyms:	Boronicacid, (6-methyl-2-pyridinyl)- (9CI);(6-Methylpyridin-2-yl)boronic acid;(6-methylpyridin-2-yl)boronic acid;boronic acid, B-(6-methyl-2-pyridinyl)-;2-Methylpyridine-6-boronic acid;
EINECS:	251-156-6
Density:	1.18 g/cm³
Boiling Point:	311.2 °C at 760 mmHg
Flash Point:	142 °C
PSA:	53.35000
LogP:	-0.93020

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Specification

The Boronic acid,B-(6-methyl-2-pyridinyl)-, with the CAS registry number 372963-50-3, has the systematic name of (6-methylpyridin-2-yl)boronic acid. It belongs to the following product categories: Boronic acid; Pyridine; Pyridines. And the molecular formula of the chemical is C₆H₈BNO₂.

The characteristics of Boronic acid,B-(6-methyl-2-pyridinyl)- are as followings: (1)ACD/LogP: 0.56; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.51; (4)ACD/LogD (pH 7.4): 0.13; (5)ACD/BCF (pH 5.5): 1.42; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 43.41; (8)ACD/KOC (pH 7.4): 17.75; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 31.35 Å²; (13)Index of Refraction: 1.527; (14)Molar Refractivity: 35.71 cm³; (15)Molar Volume: 116 cm³; (16)Polarizability: 14.15×10^-24cm³; (17)Surface Tension: 48 dyne/cm; (18)Density: 1.18 g/cm³; (19)Flash Point: 142 °C; (20)Enthalpy of Vaporization: 58.29 kJ/mol; (21)Boiling Point: 311.2 °C at 760 mmHg; (22)Vapour Pressure: 0.000245 mmHg at 25°C.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: OB(O)c1nc(ccc1)C
(2)InChI: InChI=1/C6H8BNO2/c1-5-3-2-4-6(8-5)7(9)10/h2-4,9-10H,1H3
(3)InChIKey: XHSGIZRXEBIOFC-UHFFFAOYAG