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779-26-0

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Basic Information
CAS No.: 779-26-0
Name: 2-ACETYLBIPHENYLENE
Molecular Structure:
Molecular Structure of 779-26-0 (2-ACETYLBIPHENYLENE)
Formula: C14H10O
Molecular Weight: 194.233
Synonyms: Ketone,2-biphenylenyl methyl (6CI,7CI,8CI);2-Acetylbiphenylene;2-Biphenylenyl methyl ketone;
Density: 1.218 g/cm3
Melting Point: 137-139 °C(lit.)
Boiling Point: 338.9 °C at 760 mmHg
Flash Point: 147.9 °C
PSA: 17.07000
LogP: 3.53660
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Specification

The Ethanone,1-(2-biphenylenyl)- is an organic compound with the formula C14H10O. The IUPAC name of this chemical is 1-biphenylen-2-ylethanone. With the CAS registry number 779-26-0, it is also named as 2-Acetylbiphenylene. The product's category is Biphenyl Derivatives. Besides, it should be stored in a dark cool and well-ventilated place.

Physical properties about Ethanone,1-(2-biphenylenyl)- are: (1)ACD/LogP: 3.39; (2)ACD/LogD (pH 5.5): 3.39; (3)ACD/LogD (pH 7.4): 3.39; (4)ACD/BCF (pH 5.5): 220.83; (5)ACD/BCF (pH 7.4): 220.83; (6)ACD/KOC (pH 5.5): 1657.59; (7)ACD/KOC (pH 7.4): 1657.59; (8)#H bond acceptors: 1; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 17.07 Å2; (11)Index of Refraction: 1.745; (12)Molar Refractivity: 64.64 cm3; (13)Molar Volume: 159.3 cm3; (14)Polarizability: 25.62×10-24cm3; (15)Surface Tension: 53.4 dyne/cm; (16)Density: 1.218 g/cm3; (17)Flash Point: 147.9 °C; (18)Enthalpy of Vaporization: 58.23 kJ/mol; (19)Boiling Point: 338.9 °C at 760 mmHg; (20)Vapour Pressure: 9.54E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(c3cc2c(c1ccccc12)cc3)C
(2)InChI: InChI=1/C14H10O/c1-9(15)10-6-7-13-11-4-2-3-5-12(11)14(13)8-10/h2-8H,1H3
(3)InChIKey: MBOITOZRTPXJIS-UHFFFAOYAL
(4)Std. InChI: InChI=1S/C14H10O/c1-9(15)10-6-7-13-11-4-2-3-5-12(11)14(13)8-10/h2-8H,1H3
(5)Std. InChIKey: MBOITOZRTPXJIS-UHFFFAOYSA-N