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CAS No.: | 292644-31-6 |
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Name: | 3-(3-AMINOPHENYL)-2H-CHROMEN-2-ONE |
Molecular Structure: | |
Formula: | C15H11NO2 |
Molecular Weight: | 237.258 |
Synonyms: | 3-(3-aminophenyl)-2H-chromen-2-one;2H-1-Benzopyran-2-one, 3-(3-aminophenyl)-;3-(3-Amino-phenyl)-chromen-2-one; |
Density: | 1.306 g/cm3 |
Melting Point: | 154-155 °C |
Boiling Point: | 483.8 °C at 760 mmHg |
Flash Point: | 294.2 °C |
PSA: | 56.23000 |
LogP: | 3.62340 |
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The 2H-1-Benzopyran-2-one,3-(3-aminophenyl)-, with the CAS registry number 292644-31-6, has the systematic name of 3-(3-aminophenyl)-2H-chromen-2-one. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of the chemical is C15H11NO2.
The characteristics of 2H-1-Benzopyran-2-one,3-(3-aminophenyl)- are as followings: (1)ACD/LogP: 2.75; (2)# of Rule of 5 Violations: 0 ; (3)#H bond acceptors: 3; (4)#H bond donors: 2; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 29.54 Å2; (7)Index of Refraction: 1.677; (8)Molar Refractivity: 68.44 cm3; (9)Molar Volume: 181.5 cm3; (10)Polarizability: 27.13×10-24cm3; (11)Surface Tension: 59.2 dyne/cm; (12)Density: 1.306 g/cm3; (13)Flash Point: 294.2 °C; (14)Enthalpy of Vaporization: 74.9 kJ/mol; (15)Boiling Point: 483.8 °C at 760 mmHg; (16)Vapour Pressure: 1.62E-09 mmHg at 25°C.
Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O=C/2Oc1ccccc1\C=C\2c3cccc(N)c3
(2)InChI: InChI=1/C15H11NO2/c16-12-6-3-5-10(8-12)13-9-11-4-1-2-7-14(11)18-15(13)17/h1-9H,16H2
(3)InChIKey: RHAQPESVLRVQJU-UHFFFAOYAT