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[2,2':6',2''-Terpyridine]-4'-carboxylicacid

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Name

[2,2':6',2''-Terpyridine]-4'-carboxylicacid

EINECS N/A
CAS No. 148332-36-9 Density 1.306 g/cm3
PSA 75.97000 LogP 2.90380
Solubility Slightly soluble in water. Melting Point 280-282℃
Formula C16H11N3O2 Boiling Point 582.629 °C at 760 mmHg
Molecular Weight 277.282 Flash Point 306.163 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 148332-36-9 (2,2':6',2''-TERPYRIDINE-4'-CARBOXYLIC ACID) Hazard Symbols N/A
Synonyms

Acide 2,2':6',2''-terpyridine-4'-carboxylique;

Article Data 11

[2,2':6',2''-Terpyridine]-4'-carboxylicacid Specification

The [2,2':6',2''-Terpyridine]-4'-carboxylicacid, with the CAS registry number 148332-36-9, is also known as Acide 2,2':6',2''-terpyridine-4'-carboxylique. This chemical's molecular formula is C16H11N3O2 and molecular weight is 277.2774. Its systematic name is called 2,6-bis(2-pyridyl)pyridine-4-carboxylic acid.

Physical properties of [2,2':6',2''-Terpyridine]-4'-carboxylicacid: (1)ACD/LogP: 1.09; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 5; (7)#H bond donors: 1; (8)#Freely Rotating Bonds: 3; (9)Index of Refraction: 1.642; (10)Molar Refractivity: 76.64 cm3; (11)Molar Volume: 212.204 cm3; (12)Surface Tension: 63.302 dyne/cm; (13)Density: 1.307 g/cm3; (14)Flash Point: 306.163 °C; (15)Enthalpy of Vaporization: 91.615 kJ/mol; (16)Boiling Point: 582.629 °C at 760 mmHg; (17)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: c1ccnc(c1)c2cc(cc(n2)c3ccccn3)C(=O)O
(2)InChI: InChI=1/C16H11N3O2/c20-16(21)11-9-14(12-5-1-3-7-17-12)19-15(10-11)13-6-2-4-8-18-13/h1-10H,(H,20,21)
(3)InChIKey: ZYTWXMBGOUJDHJ-UHFFFAOYAZ

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