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CAS No.: | 62581-60-6 |
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Name: | 1-{[(2-Methylphenyl)imino]methyl}-2-naphthol |
Molecular Structure: | |
Formula: | C18H15NO |
Molecular Weight: | 261.323 |
Synonyms: | 1-(O-Tolyliminomethyl)naphthalen-2-ol; |
Density: | 1.09 g/cm3 |
Boiling Point: | 448.9 °C at 760 mmHg |
Flash Point: | 294.2 °C |
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The CAS registry number of 1-{[(2-Methylphenyl)imino]methyl}-2-naphthol is 62581-60-6. The systematic name is 1-(o-tolyliminomethyl)naphthalen-2-ol. In addition, the molecular formula is C18H15NO and the molecular weight is 261.32. What's more, it should be stored in a cool and dry place.
Physical properties about this chemical are: (1)ACD/LogP: 4.78; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.78; (4)ACD/LogD (pH 7.4): 4.73; (5)#H bond acceptors: 2; (6)#H bond donors: 1; (7)#Freely Rotating Bonds: 3; (8)Polar Surface Area: 32.59 Å2; (9)Index of Refraction: 1.601; (10)Molar Refractivity: 81.57 cm3; (11)Molar Volume: 237.9 cm3; (12)Polarizability: 32.33 ×10-24cm3; (13)Surface Tension: 41.1 dyne/cm; (14)Density: 1.09 g/cm3; (15)Flash Point: 294.2 °C; (16)Enthalpy of Vaporization: 73.47 kJ/mol; (17)Boiling Point: 448.9 °C at 760 mmHg; (18)Vapour Pressure: 1.12E-08 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Cc1ccccc1N=Cc2c3ccccc3ccc2O
(2)InChI: InChI=1/C18H15NO/c1-13-6-2-5-9-17(13)19-12-16-15-8-4-3-7-14(15)10-11-18(16)20/h2-12,20H,1H3
(3)InChIKey: DHMQBAZAQAXKEX-UHFFFAOYAJ