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198967-23-6

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Basic Information
CAS No.: 198967-23-6
Name: 4-CHLORO-2-FLUORO-N-METHOXY-N-METHYLBENZAMIDE
Article Data: 3
Molecular Structure:
Molecular Structure of 198967-23-6 (4-CHLORO-2-FLUORO-N-METHOXY-N-METHYLBENZAMIDE)
Formula: C9H9ClFNO2
Molecular Weight: 217.627
Synonyms: 4-Chloro-2-fluoro-N-methoxy-N-methylbenzamide;4-Chloro-2-fluoro-N-methyl-N-(methyloxy)benzamide;
Density: 1.301 g/cm3
Boiling Point: 338.993 °C at 760 mmHg
Flash Point: 158.818 °C
PSA: 29.54000
LogP: 2.11250
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Specification

The Benzamide,4-chloro-2-fluoro-N-methoxy-N-methyl-, with the CAS registry number 198967-23-6, is also known as 4-Chloro-2-fluoro-N-methyl-N-(methyloxy)benzamide. This chemical's molecular formula is C9H9ClFNO2 and molecular weight is 217.62. What's more, its systematic name is called 4-Chloro-2-fluoro-N-methoxy-N-methylbenzamide.

Physical properties about Benzamide,4-chloro-2-fluoro-N-methoxy-N-methyl- are: (1) ACD/LogP: 2.01; (2) # of Rule of 5 Violations: 0; (3) ACD/LogD (pH 5.5): 1; (4) ACD/LogD (pH 7.4): 1; (5) ACD/BCF (pH 5.5): 7; (6) ACD/BCF (pH 7.4): 7; (7) ACD/KOC (pH 5.5): 136; (8) ACD/KOC (pH 7.4): 136; (9) #H bond acceptors: 3; (10) #H bond donors: 0; (11) #Freely Rotating Bonds: 2; (12) Polar Surface Area: 29.54 Å2; (13) Index of Refraction: 1.525; (14) Molar Refractivity: 51.269 cm3; (15) Molar Volume: 167.247 cm3; (16) Surface Tension: 39.994 dyne/cm; (17) Density: 1.301 g/cm3; (18) Flash Point: 158.818 °C; (19) Enthalpy of Vaporization: 58.24 kJ/mol; (20) Boiling Point: 338.993 °C at 760 mmHg; (21) Vapour Pressure: 0 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(c1ccc(Cl)cc1F)N(C)OC
(2) InChI: InChI=1/C9H9ClFNO2/c1-12(14-2)9(13)7-4-3-6(10)5-8(7)11/h3-5H,1-2H3
(3) InChIKey: GYECROLIZPLTMN-UHFFFAOYAQ