2-PHENOXYPYRIDINE-3-CARBONYL CHLORIDE

The CAS register number of 3-Pyridinecarbonylchloride, 2-phenoxy- is 51362-49-3. It also can be called as 2-Phenoxynicotinoylchloride and the systematic name about this chemical is 2-Phenoxypyridine-3-carbonyl chloride. The molecular formula about this chemical is C₁₂H₈ClNO₂ and the molecular weight is 233.65.

Physical properties about 3-Pyridinecarbonylchloride, 2-phenoxy- are: (1)ACD/LogP: 2.19; (2)ACD/LogD (pH 5.5): 2.19; (3)ACD/LogD (pH 7.4): 2.19; (4)ACD/BCF (pH 5.5): 27.38; (5)ACD/BCF (pH 7.4): 27.38; (6)ACD/KOC (pH 5.5): 371.99; (7)ACD/KOC (pH 7.4): 371.99; (8)#H bond acceptors: 3 ; (9)#Freely Rotating Bonds: 3; (10)Polar Surface Area: 39.19 Å²; (11)Index of Refraction: 1.594; (12)Molar Refractivity: 61.03 cm³; (13)Molar Volume: 179.6 cm³; (14)Polarizability: 24.19x10^-24cm³; (15)Surface Tension: 49.4 dyne/cm; (16)Density: 1.3 g/cm³; (17)Flash Point: 160.1 °C; (18)Enthalpy of Vaporization: 58.47 kJ/mol; (19)Boiling Point: 341.1 °C at 760 mmHg; (20)Vapour Pressure: 8.25E-05 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following:
This chemical can cause burns. If you want to use it, wear suitable protective clothing, gloves and eye/face protection. In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.) In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. It may cause damage to health.

You can still convert the following datas into molecular structure:
(1)SMILES: ClC(=O)c2cccnc2Oc1ccccc1
(2)InChI: InChI=1/C12H8ClNO2/c13-11(15)10-7-4-8-14-12(10)16-9-5-2-1-3-6-9/h1-8H
(3)InChIKey: ILBAQNFTHRLAEH-UHFFFAOYAG
(4)Std. InChI: InChI=1S/C12H8ClNO2/c13-11(15)10-7-4-8-14-12(10)16-9-5-2-1-3-6-9/h1-8H
(5)Std. InChIKey: ILBAQNFTHRLAEH-UHFFFAOYSA-N