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1-(3,4-Dimethoxyphenyl)-2-phenylethanone

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Name

1-(3,4-Dimethoxyphenyl)-2-phenylethanone

EINECS N/A
CAS No. 3141-93-3 Density 1.115g/cm3
PSA 35.53000 LogP 3.12920
Solubility N/A Melting Point 87 °C
Formula C16H16O3 Boiling Point 398°Cat760mmHg
Molecular Weight 256.301 Flash Point 186.1°C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 3141-93-3 (3',4'-DIMETHOXY-2-PHENYLACETOPHENONE) Hazard Symbols N/A
Synonyms

Acetophenone,3',4'-dimethoxy-2-phenyl- (6CI,7CI,8CI);1-(3,4-Dimethoxyphenyl)-2-phenylethanone;Benzyl 3,4-dimethoxyphenyl ketone;

Article Data 20

1-(3,4-Dimethoxyphenyl)-2-phenylethanone Specification

The 1-(3,4-Dimethoxyphenyl)-2-phenylethanone is a kind of organic compounds with cas registry number of 3141-93-3. It is also known as Benzyl 3,4-dimethoxyphenyl ketone. This chemical has a systematic name which is called 1-(3,4-dimethoxyphenyl)-2-phenylethanone.

The physical properties about this chemical are: (1)ACD/LogP: 3.34; (2)# of Rule of 5 Violations: 0 ; (3)#H bond acceptors: 3; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 5; (6)Index of Refraction: 1.558; (7)Molar Refractivity: 74.12 cm3; (8)Molar Volume: 229.6 cm3; (9)Surface Tension: 40 dyne/cm; (10)Density: 1.115 g/cm3; (11)Flash Point: 186.1 °C; (12)Enthalpy of Vaporization: 64.85 kJ/mol; (13)Boiling Point: 398 °C at 760 mmHg; (14)Vapour Pressure: 1.53E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(c1cc(OC)c(OC)cc1)Cc2ccccc2;
(2)InChI: InChI=1/C16H16O3/c1-18-15-9-8-13(11-16(15)19-2)14(17)10-12-6-4-3-5-7-12/h3-9,11H,10H2,1-2H3;
(3)InChIKey: PCHUBNOSEWYQAT-UHFFFAOYAI

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