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2-Acetylanthracene

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Name

2-Acetylanthracene

EINECS 227-730-4
CAS No. 10210-32-9 Density 1.164 g/cm3
PSA 17.07000 LogP 4.19560
Solubility N/A Melting Point 189-192 °C(lit.)
Formula C16H12O Boiling Point 405.894 °C at 760 mmHg
Molecular Weight 220.271 Flash Point 180.724 °C
Transport Information N/A Appearance Yellow powder
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 10210-32-9 (2-Acetylanthracene) Hazard Symbols N/A
Synonyms

Ketone,2-anthryl methyl (7CI,8CI);2-Anthryl methyl ketone;

Article Data 3

2-Acetylanthracene Specification

The 2-Acetylanthracene with the cas number 10210-32-9 is also called Ethanone,1-(2-anthracenyl)-. Both the systematic name and IUPAC name are 1-anthracen-2-ylethanone. Its molecular formula is C16H12O. The product's category is Aromatics. This chemical is yellow powder.

The properties of the chemical are: (1)ACD/LogP: 4.13; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.13; (4)ACD/LogD (pH 7.4): 4.13; (5)ACD/BCF (pH 5.5): 805.41; (6)ACD/BCF (pH 7.4): 805.41  ; (7)ACD/KOC (pH 5.5): 4185.3; (8)ACD/KOC (pH 7.4): 4185.3; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 17.07 Å2; (13)Index of Refraction: 1.685; (14)Molar Refractivity: 71.96 cm3; (15)Molar Volume: 189.1 cm3; (16)Polarizability: 28.52×10-24cm3; (17)Surface Tension: 48.8 dyne/cm; (18)Enthalpy of Vaporization: 65.75 kJ/mol; (19)Vapour Pressure: 8.47×10-7 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(c3ccc2cc1ccccc1cc2c3)C
(2)InChI: InChI=1/C16H12O/c1-11(17)12-6-7-15-9-13-4-2-3-5-14(13)10-16(15)8-12/h2-10H,1H3
(3)InChIKey: DQFWGPPCMONVDS-UHFFFAOYAU  

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