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2,3'-Bipyridine,1,2,3,6-tetrahydro-

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Name

2,3'-Bipyridine,1,2,3,6-tetrahydro-

EINECS N/A
CAS No. 2743-90-0 Density 1.045 g/cm3
PSA 24.92000 LogP 2.00100
Solubility N/A Melting Point N/A
Formula C10H12N2 Boiling Point 269 °C at 760 mmHg
Molecular Weight 160.219 Flash Point 116.5 °C
Transport Information N/A Appearance Light Yellow Oil
Safety 24/25 Risk Codes 25-36
Molecular Structure Molecular Structure of 2743-90-0 ((R,S)-ANATABINE) Hazard Symbols N/A
Synonyms

(±)-1,2,3,6-Tetrahydro-2,3'-bipyridine;2-(3-Pyridyl)-1,2,3,6-tetrahydropyridine;1,2,3,6-Tetrahydro-2,3'-bipyridine;1,2,3,6-Tetrahydro-2,3'-dipyridine;D,L-Anatabine;

Article Data 11

2,3'-Bipyridine,1,2,3,6-tetrahydro- Specification

The 2,3'-Bipyridine,1,2,3,6-tetrahydro-, with the CAS registry number 2743-90-0, is also known as 1,2,3,6-Tetrahydro-2,3'-dipyridine. It belongs to the product categories of Metabolites; Nicotine Derivatives. This chemical's molecular formula is C10H12N2 and molecular weight is 160.22. What's more, its systematic name is 1,2,3,6-tetrahydro-2,3'-bipyridine. It is used as a nicotine metabolite.

Physical properties of 2,3'-Bipyridine,1,2,3,6-tetrahydro- are: (1)ACD/LogP: 0.89; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 16.13 Å2; (7)Index of Refraction: 1.546; (8)Molar Refractivity: 48.54 cm3; (9)Molar Volume: 153.1 cm3; (10)Polarizability: 19.24×10-24cm3; (11)Surface Tension: 42.8 dyne/cm; (12)Density: 1.045 g/cm3; (13)Flash Point: 116.5 °C; (14)Enthalpy of Vaporization: 50.71 kJ/mol; (15)Boiling Point: 269 °C at 760 mmHg; (16)Vapour Pressure: 0.00746 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: n1cc(ccc1)C2NC/C=C\C2
(2)InChI: InChI=1S/C10H12N2/c1-2-7-12-10(5-1)9-4-3-6-11-8-9/h1-4,6,8,10,12H,5,7H2
(3)InChIKey: SOPPBXUYQGUQHE-UHFFFAOYSA-N

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