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72692-99-0

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Basic Information
CAS No.: 72692-99-0
Name: 3-(1H-Pyrrol-1-yl)Pyridine
Article Data: 11
Molecular Structure:
Molecular Structure of 72692-99-0 (3-(1H-Pyrrol-1-yl)Pyridine)
Formula: C9H8N2
Molecular Weight: 144.176
Synonyms: 3-Pyrrol-1-yl-pyridine;Pyridine, 3-(1H-pyrrol-1-yl)-;
Density: 1.06 g/cm3
Boiling Point: 263.4 °C at 760 mmHg
Flash Point: 113.1 °C
Hazard Symbols: Xi
Risk Codes: 41
Safety: 26-39
PSA: 17.82000
LogP: 1.87230
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Specification

The 3-(1H-Pyrrol-1-yl)Pyridine, with the CAS registry number 72692-99-0, is also known as 3-Pyrrol-1-yl-pyridine. This chemical's molecular formula is C9H8N2 and molecular weight is 144.17. What's more, its systematic name is 3-(1H-Pyrrol-1-yl)Pyridine.

Physical properties of 3-(1H-Pyrrol-1-yl)Pyridine are: (1)ACD/LogP: 1.59; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 17.82 Å2; (7)Index of Refraction: 1.591; (8)Molar Refractivity: 45.93 cm3; (9)Molar Volume: 135.7 cm3; (10)Polarizability: 18.2×10-24cm3; (11)Surface Tension: 42.2 dyne/cm; (12)Density: 1.06 g/cm3; (13)Flash Point: 113.1 °C; (14)Enthalpy of Vaporization: 48.1 kJ/mol; (15)Boiling Point: 263.4 °C at 760 mmHg; (16)Vapour Pressure: 0.0168 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: n1cccc(c1)n2cccc2
(2)Std. InChI: InChI=1S/C9H8N2/c1-2-7-11(6-1)9-4-3-5-10-8-9/h1-8H
(3)Std. InChIKey: SPFWVEKHAJYTGG-UHFFFAOYSA-N