Basic Information | Post buying leads | Suppliers |
Name |
6-Fluoro-5-methylpyridine-3-boronic acid |
EINECS | N/A |
CAS No. | 904326-92-7 | Density | 1.28g/cm3 |
PSA | 53.35000 | LogP | -0.79110 |
Solubility | N/A | Melting Point |
N/A |
Formula | C6H7BFNO2 | Boiling Point | 333.5 °C at 760 mmHg |
Molecular Weight | 154.936 | Flash Point | 155.5 °C |
Transport Information | N/A | Appearance | N/A |
Safety | 26-39 | Risk Codes | 41 |
Molecular Structure | Hazard Symbols | Xi | |
Synonyms |
Boronicacid, (6-fluoro-5-methyl-3-pyridinyl)- (9CI);(2-Fluoro-3-methylpyridin-5-yl)boronic acid;(6-Fluoro-5-methylpyridin-3-yl)boronicacid;2-fluoro-3-methylpyridine-5-boronic acid; |
The 6-Fluoro-5-methylpyridine-3-boronic acid with the cas number 904326-92-7 is also called Boronic acid,B-(6-fluoro-5-methyl-3-pyridinyl)-. Both the systematic name and IUPAC name are (6-fluoro-5-methylpyridin-3-yl)boronic acid. Its molecular formula is C6H7BFNO2. This chemical belongs to the following product categories: (1)Boronic acid; (2)Organoborons; (3)Pyridine.
The properties of the chemical are: (1)ACD/LogP: 0.67; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.59; (4)ACD/BCF (pH 5.5): 1.6; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 46.32; (7)ACD/KOC (pH 7.4): 3.44; (8)#H bond acceptors: 3; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 53.35 Å2; (12)Index of Refraction: 1.504; (13)Molar Refractivity: 35.82 cm3; (14)Molar Volume: 120.8 cm3; (15)Polarizability: 14.2×10-24cm3; (16)Surface Tension: 44.8 dyne/cm; (17)Enthalpy of Vaporization: 60.83 kJ/mol; (18)Vapour Pressure: 5.41×10-5 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Cc1cc(cnc1F)B(O)O
(2)InChI: InChI=1/C6H7BFNO2/c1-4-2-5(7(10)11)3-9-6(4)8/h2-3,10-11H,1H3
(3)InChIKey: XCWIMBMPJGQNHG-UHFFFAOYAL