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2-Methyl-1,10-phenanthroline

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Name

2-Methyl-1,10-phenanthroline

EINECS 1312995-182-4
CAS No. 3002-77-5 Density 1.211 g/cm3
PSA 25.78000 LogP 3.09140
Solubility N/A Melting Point 50-53 °C
Formula C13H10N2 Boiling Point 364.872 °C at 760 mmHg
Molecular Weight 194.236 Flash Point 161.376 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 3002-77-5 (2-methyl-1,10-phenanthroline) Hazard Symbols N/A
Synonyms

2-Methyl-1,10-phenanthrolin; 1,10-Phenanthroline,2-methyl; 2-Me-1,10-phenanthroline; 2-methylphenanthroline; 2-methyl-[1,10]phenanthroline;

Article Data 21

2-Methyl-1,10-phenanthroline Specification

The 2-Methyl-1,10-phenanthroline, with the CAS registry number 3002-77-5, is also known as 1,10-Phenanthroline, 2-methyl-. This chemical's molecular formula is C13H10N2 and molecular weight is 194.23. What's more, its systematic name is 2-Methyl-1,10-phenanthroline.

Physical properties of 2-Methyl-1,10-phenanthroline are: (1)ACD/LogP: 2.24; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.88; (4)ACD/LogD (pH 7.4): 2.23; (5)ACD/BCF (pH 5.5): 12.86; (6)ACD/BCF (pH 7.4): 29.20; (7)ACD/KOC (pH 5.5): 170.74; (8)ACD/KOC (pH 7.4): 387.69; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 25.78 Å2; (13)Index of Refraction: 1.714; (14)Molar Refractivity: 62.945 cm3; (15)Molar Volume: 160.388 cm3; (16)Polarizability: 24.953×10-24cm3; (17)Surface Tension: 57.1 dyne/cm; (18)Density: 1.211 g/cm3; (19)Flash Point: 161.376 °C; (20)Enthalpy of Vaporization: 58.706 kJ/mol; (21)Boiling Point: 364.872 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: n1c3c(ccc1)ccc2ccc(nc23)C
(2)Std. InChI: InChI=1S/C13H10N2/c1-9-4-5-11-7-6-10-3-2-8-14-12(10)13(11)15-9/h2-8H,1H3
(3)Std. InChIKey: LQZDYPHFVGRHKD-UHFFFAOYSA-N

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