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64953-82-8

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Basic Information
CAS No.: 64953-82-8
Name: 2-Chloro-1-(4-ethoxyphenyl)ethanone
Article Data: 5
Molecular Structure:
Molecular Structure of 64953-82-8 (2-Chloro-1-(4-ethoxyphenyl)ethanone)
Formula: C10H11ClO2
Molecular Weight: 198.6461
Synonyms: ZINC 04200368;
Density: 1.149 g/cm3
Boiling Point: 316.2 °C at 760 mmHg
Flash Point: 136 °C
PSA: 26.30000
LogP: 2.50680
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Specification

The 2-Chloro-1-(4-ethoxyphenyl)ethanone, with the CAS registry number 64953-82-8, is also known as ZINC 04200368. This chemical's molecular formula is C10H11ClO2 and molecular weight is 198.6461. What's more, its IUPAC name is 2-Chloro-1-(4-ethoxyphenyl)ethanone.

Physical properties about 2-Chloro-1-(4-ethoxyphenyl)ethanone are: (1)ACD/LogP: 2.45; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 4; (6)Polar Surface Area: 26.3 Å2; (7)Index of Refraction: 1.518; (8)Molar Refractivity: 52.44 cm3; (9)Molar Volume: 172.8 cm3; (10)Polarizability: 20.78×10-24 cm3; (11)Surface Tension: 37.3 dyne/cm; (12)Density: 1.149 g/cm3; (13)Flash Point: 136 °C; (14)Enthalpy of Vaporization: 55.75 kJ/mol; (15)Boiling Point: 316.2 °C at 760 mmHg; (16)Vapour Pressure: 0.000416 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: ClCC(=O)c1ccc(OCC)cc1
(2) InChI: InChI=1/C10H11ClO2/c1-2-13-9-5-3-8(4-6-9)10(12)7-11/h3-6H,2,7H2,1H3
(3) InChIKey: ZYLJLWLQPBRDLN-UHFFFAOYAK