Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
5-Chloro-2-methoxypyridine-4-boronic acid |
EINECS | N/A |
CAS No. | 475275-69-5 | Density | 1.403 g/cm3 |
PSA | 62.58000 | LogP | -0.57660 |
Solubility | N/A | Melting Point |
N/A |
Formula | C6H7BClNO3 | Boiling Point | 347.608 °C at 760 mmHg |
Molecular Weight | 187.39 | Flash Point | 164.028 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | 22 | |
Molecular Structure | Hazard Symbols | Xn | |
Synonyms |
Boronic acid, (5-chloro-2-methoxy-4-pyridinyl)- (9CI); |
Article Data | 8 |
This chemical is called (5-Chloro-2-methoxy-4-pyridinyl)boronic acid, and its CAS registry number is 475275-69-5. With the molecular formula of C6H7BClNO3, its molecular weight is 187.39. Additionally, its product category is Boronicacid.
Other characteristics of the (5-Chloro-2-methoxy-4-pyridinyl)boronic acid can be summarised as followings: (1)ACD/LogP: 1.39; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1; (4)ACD/LogD (pH 7.4): 0; (5)ACD/BCF (pH 5.5): 6; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 124; (8)ACD/KOC (pH 7.4): 15; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 62.58 Å2; (13)Index of Refraction: 1.546; (14)Molar Refractivity: 42.279 cm3; (15)Molar Volume: 133.589 cm3; (16)Polarizability: 16.761×10-24cm3; (17)Surface Tension: 54.525 dyne/cm; (18)Density: 1.403 g/cm3; (19)Flash Point: 164.028 °C; (20)Enthalpy of Vaporization: 62.465 kJ/mol; (21)Boiling Point: 347.608 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: B(c1cc(ncc1Cl)OC)(O)O
2.InChI: InChI=1/C6H7BClNO3/c1-12-6-2-4(7(10)11)5(8)3-9-6/h2-3,10-11H,1H3
3.InChIKey: ONFAPGPPGOLJST-UHFFFAOYAT