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CAS No.: | 54173-36-3 |
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Name: | 1-(5-CHLORO-2,4-DIMETHOXY-PHENYL)-ETHANONE |
Article Data: | 4 |
Molecular Structure: | |
Formula: | C10H11ClO3 |
Molecular Weight: | 214.649 |
Synonyms: | Ethanone, 1-(5-chloro-2,4-dimethoxyphenyl)-;1-Acetyl-5-chloro-2,4-dimethoxybenzene; |
Density: | 1.186 g/cm3 |
Boiling Point: | 336.3 °C at 760 mmHg |
Flash Point: | 144.8 °C |
PSA: | 35.53000 |
LogP: | 2.55980 |
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The 1-(5-Chloro-2,4-dimethoxy-phenyl)ethanone, with the CAS registry number 54173-36-3, is also known as Ethanone, 1-(5-chloro-2,4-dimethoxyphenyl)- and 1-Acetyl-5-chloro-2,4-dimethoxybenzene. This chemical's molecular formula is C10H11ClO3 and molecular weight is 214.6455.
Physical properties about 1-(5-Chloro-2,4-dimethoxy-phenyl)ethanone: (1)ACD/LogP: 2.72; (2)#of Rule of 5 Violations: 0; (3)#H bond acceptors: 3; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 3; (6)Polar Surface Area: 35.53 Å2; (7)Index of Refraction: 1.514; (8)Molar Refractivity: 54.53 cm3; (9)Molar Volume: 180.9 cm3; (10)Surface Tension: 35.5 dyne/cm; (11)Density: 1.186 g/cm3; (12)Flash Point: 144.8 °C; (13)Enthalpy of Vaporization: 57.95 kJ/mol; (14)Boiling Point: 336.3 °C at 760 mmHg; (15)Vapour Pressure: 0.000113 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: Clc1cc(c(OC)cc1OC)C(=O)C
(2) InChI: InChI=1/C10H11ClO3/c1-6(12)7-4-8(11)10(14-3)5-9(7)13-2/h4-5H,1-3H3
(3) InChIKey: PGJNIQOOMMZXFU-UHFFFAOYAB