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CAS No.: | 784-45-2 |
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Name: | 3-Nitroso-2-phenyl-1H-indole |
Article Data: | 8 |
Molecular Structure: | |
Formula: | C14H10N2O |
Molecular Weight: | 222.246 |
Synonyms: | 1H-indole, 3-nitroso-2-phenyl- |
Density: | 1.24 g/cm3 |
Boiling Point: | 467.4 °C at 760 mmHg |
Flash Point: | 236.5 °C |
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This chemical is called 3-Nitroso-2-phenyl-1H-indole, and its CAS registry number is 784-45-2. With the molecular formula of C14H10N2O, its molecular weight is 222.24.
Other characteristics of the chemical can be summarised as followings: (1)ACD/LogP: 5.27; (2)# of Rule of 5 Violations: 1; (3)#H bond acceptors: 3; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 34.36 Å2; (7)Index of Refraction: 1.663; (8)Molar Refractivity: 66.37 cm3; (9)Molar Volume: 179.1 cm3; (10)Polarizability: 26.31×10-24cm3; (11)Surface Tension: 49.7 dyne/cm; (12)Density: 1.24 g/cm3; (13)Flash Point: 236.5 °C; (14)Enthalpy of Vaporization: 70.15 kJ/mol; (15)Boiling Point: 467.4 °C at 760 mmHg; (16)Vapour Pressure: 1.83E-08 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: O=Nc2c1ccccc1nc2c3ccccc3|
2.InChI: InChI=1/C14H10N2O/c17-16-14-11-8-4-5-9-12(11)15-13(14)10-6-2-1-3-7-10/h1-9,15H|InChIKey:
OKRIMXDIYQGPBU-UHFFFAOYAC