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244263-45-4

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Basic Information
CAS No.: 244263-45-4
Name: 1-(6-Chloropyridin-3-yl)-2-methylpropan-1-one
Molecular Structure:
Molecular Structure of 244263-45-4 (1-(6-Chloropyridin-3-yl)-2-methylpropan-1-one)
Formula: C9H10ClNO
Molecular Weight: 183.637
Synonyms: 1-(6-CHLOROPYRIDIN-3-YL)-2-METHYLPROPAN-1-ONE
Density: 1.151 g/cm3
Boiling Point: 297.8 °C at 760 mmHg
Flash Point: 133.9 °C
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Specification

The 1-Propanone,1-(6-chloro-3-pyridinyl)-2-methyl-, with the CAS registry number 244263-45-4, has the systematic name of 1-(6-chloropyridin-3-yl)-2-methylpropan-1-one. And the molecular formula of this chemical is C9H10ClNO. In addition, it belongs to the product category of Pharmacetical.

The physical properties of 1-Propanone,1-(6-chloro-3-pyridinyl)-2-methyl- are as following: (1)ACD/LogP: 2.11; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.11; (4)ACD/LogD (pH 7.4): 2.11; (5)ACD/BCF (pH 5.5): 23.61; (6)ACD/BCF (pH 7.4): 23.61; (7)ACD/KOC (pH 5.5): 334.55; (8)ACD/KOC (pH 7.4): 334.55; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 29.96 Å2; (13)Index of Refraction: 1.519; (14)Molar Refractivity: 48.49 cm3; (15)Molar Volume: 159.5 cm3; (16)Polarizability: 19.22×10-24cm3; (17)Surface Tension: 39.2 dyne/cm; (18)Density: 1.151 g/cm3; (19)Flash Point: 133.9 °C; (20)Enthalpy of Vaporization: 53.77 kJ/mol; (21)Boiling Point: 297.8 °C at 760 mmHg; (22)Vapour Pressure: 0.00132 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(c1cnc(Cl)cc1)C(C)C
(2)Std. InChI: InChI=1S/C9H10ClNO/c1-6(2)9(12)7-3-4-8(10)11-5-7/h3-6H,1-2H3
(3)Std. InChIKey: YHXOBWLYRVQSDI-UHFFFAOYSA-N