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159092-68-9

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Basic Information
CAS No.: 159092-68-9
Name: 1,10-dinitrophenanthrene
Molecular Structure:
Molecular Structure of 159092-68-9 (1,10-dinitrophenanthrene)
Formula: C14H8N2O4
Molecular Weight: 268.229
Synonyms: 1,10-Dinitrophenanthrene;
Density: 1.479 g/cm3
Boiling Point: 485.7 °C at 760 mmHg
Flash Point: 248 °C
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Specification

The Phenanthrene,1,10-dinitro- is an organic compound with the formula C14H8N2O4. The IUPAC name of this chemical is 1,10-Dinitrophenanthrene. The CAS registry number of this chemical is 159092-68-9. Besides, its molecular weight is 268.2243.

Physical properties about Phenanthrene,1,10-dinitro- are: (1)ACD/LogP: 3.75; (2)ACD/LogD (pH 5.5): 3.75; (3)ACD/LogD (pH 7.4): 3.75; (4)ACD/BCF (pH 5.5): 417.38; (5)ACD/BCF (pH 7.4): 417.38; (6)ACD/KOC (pH 5.5): 2614.45; (7)ACD/KOC (pH 7.4): 2614.45; (8)#H bond acceptors: 6; (9)#Freely Rotating Bonds: 2; (10)Polar Surface Area: 91.64 Å2; (11)Index of Refraction: 1.765; (12)Molar Refractivity: 75.02 cm3; (13)Molar Volume: 181.3 cm3; (14)Polarizability: 29.74×10-24 cm3; (15)Surface Tension: 70.7 dyne/cm; (16)Density: 1.479 g/cm3; (17)Flash Point: 248 °C; (18)nthalpy of Vaporization: 72.26 kJ/mol; (19)Boiling Point: 485.7 °C at 760 mmHg; (20)Vapour Pressure: 4.09E-09 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C14H8N2O4/c17-15(18)12-7-3-6-11-10-5-2-1-4-9(10)8-13(14(11)12)16(19)20/h1-8H
(2)InChIKey: WOPYAFSUGHOZBW-UHFFFAOYAA
(3)Std. InChI: InChI=1S/C14H8N2O4/c17-15(18)12-7-3-6-11-10-5-2-1-4-9(10)8-13(14(11)12)16(19)20/h1-8H
(4)Std. InChIKey: WOPYAFSUGHOZBW-UHFFFAOYSA-N