CAS No.71924-62-4,6-Fluoroveratraldehyde Suppliers

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Basic Information

Molecular Structure:
CAS No.:	71924-62-4
Name:	6-Fluoroveratraldehyde
Article Data:	3

Formula:	C₉H₉FO₃
Molecular Weight:	184.167
Synonyms:	2-Fluoro-4,5-dimethoxybenzaldehyde;4,5-Dimethoxy-2-fluorobenzaldehyde;6-Fluoroveratraldehyde;
EINECS:	-0
Density:	1.201 g/cm³
Melting Point:	93-97 °C(lit.)
Boiling Point:	273.3 °C at 760 mmHg
Flash Point:	115.5 °C
Appearance:	white to slightly yellow crystalline powder
Hazard Symbols:	Xi
Risk Codes:	36/37/38
Safety:	26-36
PSA:	35.53000
LogP:	1.65540

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Specification

This chemical is called 6-Fluoroveratraldehyde, and its systematic name is 2-fluoro-4,5-dimethoxybenzaldehyde. With the CAS registry number of 71924-62-4, its product categories are Catechol Derivatives; Aromatic Aldehydes & Derivatives (substituted); Benzaldehyde; Adehydes, Acetals & Ketones; Anisoles, Alkyloxy Compounds & Phenylacetates; Fluorine Compounds; C9; Carbonyl Compounds. Additionally, it should be stored sealed in the cool and dry plcace, away from oxide, alkali and air.

Other characteristics of the 6-Fluoroveratraldehyde can be summarised as followings: (1)ACD/LogP: 1.88; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.88; (4)ACD/LogD (pH 7.4): 1.88; (5)ACD/BCF (pH 5.5): 15.9; (6)ACD/BCF (pH 7.4): 15.9; (7)ACD/KOC (pH 5.5): 252.09; (8)ACD/KOC (pH 7.4): 252.09; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 35.53 Å²; (13)Index of Refraction: 1.516; (14)Molar Refractivity: 46.35 cm³; (15)Molar Volume: 153.3 cm³; (16)Polarizability: 18.37×10^-24cm³; (17)Surface Tension: 34.9 dyne/cm; (18)Density: 1.201 g/cm³; (19)Flash Point: 115.5 °C; (20)Enthalpy of Vaporization: 51.16 kJ/mol; (21)Boiling Point: 273.3 °C at 760 mmHg; (22)Vapour Pressure: 0.00579 mmHg at 25°C.

Production method of this chemical: The 6-Fluoroveratraldehyde could be obtained by the reactants of dichloro-methoxy-methane and 4-fluoroveratrole. This reaction needs the reagent of TiCl₄, and the solvent of CH₂Cl₂. This reaction should be taken for 4.5 hours. The yield is 60 %.

Uses of this chemical: The 1,2-Dimethoxy-4-fluoro-5-chloromethylbenzene could be obtained by the reactant of 6-Fluoroveratraldehyde. This reaction needs the reagents of HCl gas, 37percent formalin, and the solvent of acetic acid. The yield is 98 %. This reaction should be taken at the temperature of 30 °C.

When you are using this chemical, please be cautious about it as the following: This chemical is irritating to eyes, respiratory system and skin. You should wear suitable protective clothing when you use it. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
1.SMILES: Fc1cc(OC)c(OC)cc1C=O
2.InChI: InChI=1/C9H9FO3/c1-12-8-3-6(5-11)7(10)4-9(8)13-2/h3-5H,1-2H3
3.InChIKey: IBBYQNVXKFMSSI-UHFFFAOYAT