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2,2':6',2''-Terpyridine,4',6,6''-trimethyl- (9CI)

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Name

2,2':6',2''-Terpyridine,4',6,6''-trimethyl- (9CI)

EINECS N/A
CAS No. 316800-48-3 Density 1.108 g/cm3
PSA 38.67000 LogP 4.13080
Solubility N/A Melting Point N/A
Formula C18H17N3 Boiling Point 397.2 °C at 760 mmHg
Molecular Weight 275.353 Flash Point 169.3 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 316800-48-3 (4',6,6''-TRIMETHYL-2,2':6',2''-TERPYRIDINE) Hazard Symbols N/A
Synonyms

4',6,6''-Trimethyl-2,2':6',2''-terpyridin;

 

2,2':6',2''-Terpyridine,4',6,6''-trimethyl- (9CI) Specification

The 2,2':6',2''-Terpyridine,4',6,6''-trimethyl- (9CI), with the CAS registry number 316800-48-3, is also known as 4',6,6''-Trimethyl-2,2':6',2''-terpyridin. This chemical's molecular formula is C18H17N3 and molecular weight is 275.35. Its systematic name is called 4',6,6''-Trimethyl-2,2':6',2''-terpyridine.

Physical properties of 2,2':6',2''-Terpyridine,4',6,6''-trimethyl- (9CI): (1)ACD/LogP: 3.51; (2)ACD/LogD (pH 5.5): 3.2; (3)ACD/LogD (pH 7.4): 3.5; (4)#H bond acceptors: 3; (5)#Freely Rotating Bonds: 2; (6)Index of Refraction: 1.592; (7)Molar Refractivity: 84.18 cm3; (8)Molar Volume: 248.4 cm3; (9)Surface Tension: 46.6 dyne/cm; (10)Density: 1.108 g/cm3; (11)Flash Point: 169.3 °C; (12)Enthalpy of Vaporization: 62.24 kJ/mol; (13)Boiling Point: 397.2 °C at 760 mmHg; (14)Vapour Pressure: 3.7E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Cc1cccc(n1)c2cc(cc(n2)c3cccc(n3)C)C
(2)InChI: InChI=1/C18H17N3/c1-12-10-17(15-8-4-6-13(2)19-15)21-18(11-12)16-9-5-7-14(3)20-16/h4-11H,1-3H3
(3)InChIKey: FPRVNCMHEUJYIX-UHFFFAOYAJ

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