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1092961-07-3

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Basic Information
CAS No.: 1092961-07-3
Name: 4-Fluoro-1-methylindazole
Article Data: 3
Molecular Structure:
Molecular Structure of 1092961-07-3 (4-Fluoro-1-methylindazole)
Formula: C8H7FN2
Molecular Weight: 150.153
Synonyms: 4-fluoro-1-methyl-indazole;4-fluoro-1-methyl-1H-indazole;1H-indazole, 4-fluoro-1-methyl-;
Density: 1.23 g/cm3
Boiling Point: 236.1 °C at 760 mmHg
Flash Point: 96.6 °C
PSA: 17.82000
LogP: 1.71240
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Specification

The 1H-Indazole,4-fluoro-1-methyl-, with the CAS registry number 1092961-07-3, has the systmatic name of 4-fluoro-1-methyl-indazole. It belongs to the product categories of Building Blocks and Indazole. And the molecular formula of this chemical is C8H7FN2.

The physical properties of 1H-Indazole,4-fluoro-1-methyl- are as following: (1)ACD/LogP: 1.98; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.98; (4)ACD/LogD (pH 7.4): 1.98; (5)#H bond acceptors: 2; (6)#H bond donors: 0; (7)#Freely Rotating Bonds: 0; (8)Polar Surface Area: 17.82 Å2; (9)Index of Refraction: 1.588; (10)Molar Refractivity: 41 cm3; (11)Molar Volume: 121.7 cm3; (12)Polarizability: 16.25×10-24cm3; (13)Surface Tension: 36.9 dyne/cm; (14)Density: 1.23 g/cm3; (15)Flash Point: 96.6 °C; (16)Enthalpy of Vaporization: 45.37 kJ/mol; (17)Boiling Point: 236.1 °C at 760 mmHg; (18)Vapour Pressure: 0.0739 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Cn1c2cccc(c2cn1)F
(2)InChI: InChI=1/C8H7FN2/c1-11-8-4-2-3-7(9)6(8)5-10-11/h2-5H,1H3
(3)InChIKey: CMBZCBOBAXOMTI-UHFFFAOYAZ