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69966-55-8

Basic Information
CAS No.: 69966-55-8
Name: 3-(Bromomethyl)pyridine
Article Data: 1
Molecular Structure:
Molecular Structure of 69966-55-8 (3-(Bromomethyl)pyridine)
Formula: C6H6BrN
Molecular Weight: 172.024
Synonyms: Pyridine, 3-(bromomethyl)-;3-(Bromomethyl)pyridine Hydrobromide;
Density: 1.533 g/cm3
Melting Point: 203-205 °C(Solv: dichloromethane (75-09-2); ligroine (8032-32-4))
Boiling Point: 223.8 °C at 760 mmHg
Flash Point: 89.1 °C
PSA: 12.89000
LogP: 1.97650
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Specification

The CAS register number of Pyridine, 3-(bromomethyl)- is 69966-55-8. It also can be called as 3-(Bromomethyl)pyridine Hydrobromide and the IUPAC name about this chemical is 3-(bromomethyl)pyridine. The molecular formula about this chemical is C6H6BrN and the molecular weight is 172.02254.

Physical properties about Pyridine, 3-(bromomethyl)- are: (1)ACD/LogP: 1.43; (2)#H bond acceptors: 1; (3)#Freely Rotating Bonds: 1; (4)Polar Surface Area: 12.89Å2; (5)Index of Refraction: 1.573; (6)Molar Refractivity: 36.99 cm3; (7)Molar Volume: 112.1 cm3; (8)Polarizability: 14.66x10-24cm3; (9)Surface Tension: 44.9 dyne/cm; (10)Flash Point: 89.1 °C; (11)Enthalpy of Vaporization: 44.15 kJ/mol; (12)Boiling Point: 223.8 °C at 760 mmHg; (13)Vapour Pressure: 0.141 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: BrCc1cccnc1
(2)InChI: InChI=1/C6H6BrN/c7-4-6-2-1-3-8-5-6/h1-3,5H,4H2
(3)InChIKey: KHCXGFNZZRXOND-UHFFFAOYAB
(4)Std. InChI: InChI=1S/C6H6BrN/c7-4-6-2-1-3-8-5-6/h1-3,5H,4H2
(5)Std. InChIKey: KHCXGFNZZRXOND-UHFFFAOYSA-N