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6-Chloro-2-methylpyridine-3-boronic acid

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Name

6-Chloro-2-methylpyridine-3-boronic acid

EINECS N/A
CAS No. 913836-15-4 Density 1.34 g/cm3
PSA N/A LogP N/A
Solubility N/A Melting Point 154-156°C
Formula C6H7BClNO2 Boiling Point 336.6 °C at 760 mmHg
Molecular Weight 171.391 Flash Point 157.4 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 913836-15-4 (6-Chloro-2-methylpyridine-3-boronic acid) Hazard Symbols IrritantXi
Synonyms

Boronicacid, (6-chloro-2-methyl-3-pyridinyl)- (9CI);

 

6-Chloro-2-methylpyridine-3-boronic acid Specification

The 6-Chloro-2-methylpyridine-3-boronic acid, with CAS registry number 913836-15-4, belongs to the following product categories: (1)Blocks; (2)Boronic Acids; (3)Pyridines. It has the systematic name of (6-chloro-2-methyl-3-pyridyl)boronic acid. This chemical should be kept cold.

Physical properties of 6-Chloro-2-methylpyridine-3-boronic acid: (1)ACD/LogP: 1.23; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.1; (4)#H bond acceptors: 3; (5)#H bond donors: 2; (6)#Freely Rotating Bonds: 3; (7)Polar Surface Area: 53.35 Å2; (8)Index of Refraction: 1.55; (9)Molar Refractivity: 40.53 cm3; (10)Molar Volume: 127.2 cm3; (11)Polarizability: 16.07×10-24cm3; (12)Surface Tension: 52.5 dyne/cm; (13)Enthalpy of Vaporization: 61.19 kJ/mol; (14)Vapour Pressure: 4.35E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: B(c1ccc(nc1C)Cl)(O)O
(2)InChI: InChI=1/C6H7BClNO2/c1-4-5(7(10)11)2-3-6(8)9-4/h2-3,10-11H,1H3
(3)InChIKey: WEKRUIAZOLIAOG-UHFFFAOYAM
(4)Std. InChI: InChI=1S/C6H7BClNO2/c1-4-5(7(10)11)2-3-6(8)9-4/h2-3,10-11H,1H3
(5)Std. InChIKey: WEKRUIAZOLIAOG-UHFFFAOYSA-N

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