3-Chloro-2-methoxypyridine-4-boronic acid supplier

Name
3-Chloro-2-methoxypyridin-4-ylboronic acid
EINECS
CAS No. 957060-88-7
Density 1.4 g/cm³
Solubility
Melting Point 140 °C
Formula C₆H₇BClNO₃
Boiling Point 344.3 °C at 760 mmHg
Molecular Weight 187.39
Flash Point 162 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms (3-chloro-2-methoxypyridin-4-yl)boronic acid
PSA 62.58000
LogP -0.57660

3-Chloro-2-methoxypyridine-4-boronic acid Specification

The 3-Chloro-2-methoxypyridine-4-boronic acid, with its CAS registry number 957060-88-7, has the systematic name of (3-chloro-2-methoxy-4-pyridyl)boronic acid. And it has the molecular formula of C₆H₇BClNO₃. Besides, it belongs to the product categories which include Blocks; Boronic Acids; Pyridines; Heterocyclic Compounds; Organoborons; Pyridine.

The characteristics of 3-Chloro-2-methoxypyridine-4-boronic acid are as follows: (1)ACD/LogP: 1.49; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.45; (4)ACD/LogD (pH 7.4): 0.54; (5)#H bond acceptors: 4; (6)#H bond donors: 2; (7)#Freely Rotating Bonds: 4; (8)Polar Surface Area: 62.58 Å²; (9)Index of Refraction: 1.545; (10)Molar Refractivity: 42.27 cm³; (11)Molar Volume: 133.5 cm³; (12)Polarizability: 16.76×10^-24cm³; (13)Surface Tension: 54.5 dyne/cm; (14)Density: 1.4 g/cm³; (15)Flash Point: 162 °C; (16)Enthalpy of Vaporization: 62.09 kJ/mol; (17)Boiling Point: 344.3 °C at 760 mmHg; (18)Vapour Pressure: 2.53E-05 mmHg at 25°C.

What's more, the following datas could be converted into the molecular structure:
(1)SMILES:Clc1c(ccnc1OC)B(O)O
(2)InChI:InChI=1/C6H7BClNO3/c1-12-6-5(8)4(7(10)11)2-3-9-6/h2-3,10-11H,1H3
(3)InChIKey:YQNAXOGPSUVHNU-UHFFFAOYAL
(4)Std. InChI:InChI=1S/C6H7BClNO3/c1-12-6-5(8)4(7(10)11)2-3-9-6/h2-3,10-11H,1H3
(5)Std. InChIKey:YQNAXOGPSUVHNU-UHFFFAOYSA-N

Product Name

3-Chloro-2-methoxypyridin-4-ylboronic acid

3-Chloro-2-methoxypyridine-4-boronic acid Specification

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