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CAS No.: | 5467-18-5 |
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Name: | N,N-bis(2-hydroxyethyl)-3,5-dinitrobenzamide |
Molecular Structure: | |
Formula: | C11H13N3O7 |
Molecular Weight: | 299.24 |
Synonyms: | NSC27139; |
Density: | 1.523 g/cm3 |
Boiling Point: | 564 °C at 760 mmHg |
Flash Point: | 294.9 °C |
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The Benzamide, N,N-bis(2-hydroxyethyl)-3,5-dinitro-, with the CAS registry number 5467-18-5, has the molecular formula C11H13N3O7. Besides, its molecular weight is 299.2368. Its systematic name is called N,N-bis(2-hydroxyethyl)-3,5-dinitrobenzamide.
Physical properties of Benzamide, N,N-bis(2-hydroxyethyl)-3,5-dinitro-: (1)ACD/LogP: -1.06 ; (2)#H bond acceptors: 10; (3)#H bond donors: 2; (4)#Freely Rotating Bonds: 9; (5)Index of Refraction: 1.631; (6)Molar Refractivity: 70.06 cm3; (7)Molar Volume: 196.4 cm3; (8)Surface Tension: 77 dyne/cm; (9)Density: 1.523 g/cm3; (10)Flash Point: 294.9 °C; (11)Enthalpy of Vaporization: 89.16 kJ/mol; (12)Boiling Point: 564 °C at 760 mmHg; (13)Vapour Pressure: 1.47E-13 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=[N+]([O-])c1cc(cc([N+]([O-])=O)c1)C(=O)N(CCO)CCO
(2)InChI: InChI=1/C11H13N3O7/c15-3-1-12(2-4-16)11(17)8-5-9(13(18)19)7-10(6-8)14(20)21/h5-7,15-16H,1-4H2
(3)InChIKey: QCBILXDORALCKA-UHFFFAOYAR