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CAS No.: | 6319-58-0 |
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Name: | 2,5-dimethyl-1-(9H-xanthen-9-yl)-1H-pyrrole |
Molecular Structure: | |
Formula: | C19H17NO |
Molecular Weight: | 275.3444 |
Density: | 1.14 g/cm3 |
Boiling Point: | 417.9 °C at 760 mmHg |
Flash Point: | 206.5 °C |
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The CAS registry number of 1H-Pyrrole,2,5-dimethyl-1-(9H-xanthen-9-yl)- is 6319-58-0. This chemical's molecular formula is C19H17NO and molecular weight is 275.3444. What's more, its systematic name is called 2,5-Dimethyl-1-(9H-xanthen-9-yl)-1H-pyrrole.
Physical properties about 1H-Pyrrole,2,5-dimethyl-1-(9H-xanthen-9-yl)- are: (1)ACD/LogP: 5.08 ; (2)#of Rule of 5 Violations: 1; (3)#H bond acceptors: 2; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 1; (6)Polar Surface Area: 14.16 Å2; (7)Index of Refraction: 1.625; (8)Molar Refractivity: 84.88 cm3; (9)Molar Volume: 239.9 cm3; (10)Polarizability: 33.65×10-24 cm3; (11)Surface Tension: 40.9 dyne/cm; (12)Density: 1.14 g/cm3; (13)Flash Point: 206.5 °C; (14)Enthalpy of Vaporization: 64.53 kJ/mol; (15)Boiling Point: 417.9 °C at 760 mmHg; (16)Vapour Pressure: 8.31E-07 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: O2c1ccccc1C(c3c2cccc3)n4c(ccc4C)C
(2) InChI: InChI=1/C19H17NO/c1-13-11-12-14(2)20(13)19-15-7-3-5-9-17(15)21-18-10-6-4-8-16(18)19/h3-12,19H,1-2H3
(3) InChIKey: OFIUEIIKBVLHPT-UHFFFAOYAM