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CAS No.: | 134767-27-4 |
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Name: | acridine-4-carboxamide |
Molecular Structure: | |
Formula: | C14H10N2O |
Molecular Weight: | 222.242 |
Density: | 1.31g/cm3 |
Boiling Point: | 511 °C at 760 mmHg |
Flash Point: | 262.8 °C |
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The 4-Acridinecarboxamide, with CAS registry number 134767-27-4, has the systematic name of acridine-4-carboxamide. Its molecular weight is 222.242. And the chemical formula of this chemical is C14H10N2O.
Physical properties of 4-Acridinecarboxamide: (1)ACD/LogP: 1.92; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.91; (4)ACD/LogD (pH 7.4): 1.92; (5)ACD/BCF (pH 5.5): 16.63; (6)ACD/BCF (pH 7.4): 17.01; (7)ACD/KOC (pH 5.5): 258.68; (8)ACD/KOC (pH 7.4): 264.59; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 33.2 Å2; (13)Index of Refraction: 1.748; (14)Molar Refractivity: 68.95 cm3; (15)Molar Volume: 169.5 cm3; (16)Polarizability: 27.33×10-24cm3; (17)Surface Tension: 66 dyne/cm; (18)Density: 1.31 g/cm3; (19)Flash Point: 262.8 °C; (20)Enthalpy of Vaporization: 78.18 kJ/mol; (21)Boiling Point: 511 °C at 760 mmHg; (22)Vapour Pressure: 1.48E-10 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(c2cccc1cc3c(nc12)cccc3)N
(2)InChI: InChI=1/C14H10N2O/c15-14(17)11-6-3-5-10-8-9-4-1-2-7-12(9)16-13(10)11/h1-8H,(H2,15,17)
(3)InChIKey: KCBDLLNCTLQLPL-UHFFFAOYAV
(4)Std. InChI: InChI=1S/C14H10N2O/c15-14(17)11-6-3-5-10-8-9-4-1-2-7-12(9)16-13(10)11/h1-8H,(H2,15,17)
(5)Std. InChIKey: KCBDLLNCTLQLPL-UHFFFAOYSA-N