CAS No.240494-70-6,[2,3,5,6-tetrafluoro-4-(methoxymethyl)phenyl]methyl 2,2-dimethyl-3-pro p-1-enyl-cyclopropane-1-carboxylate Suppliers

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Basic Information

Molecular Structure:
CAS No.:	240494-70-6
Name:	[2,3,5,6-tetrafluoro-4-(methoxymethyl)phenyl]methyl 2,2-dimethyl-3-pro p-1-enyl-cyclopropane-1-carboxylate
Article Data:	2

Formula:	C₁₈H₂₀F₄O₃
Molecular Weight:	360.349
Synonyms:	Cyclopropanecarboxylicacid, 2,2-dimethyl-3-(1-propenyl)-,[2,3,5,6-tetrafluoro-4-(methoxymethyl)phenyl]methyl ester (9CI);Eminence;Metofluthrin;SumiOne;
Density:	1.278 g/cm³
Boiling Point:	336.3 °C at 760 mmHg
Flash Point:	152 °C
PSA:	35.53000
LogP:	4.28090

Synthetic route

: 83282-91-1
2,3,5,6-tetrafluoro-4-(methoxymethyl)benzyl alcohol

: 40447-55-0
2,2-dimethyl-3-(1-propenyl) cyclopropane methyl carboxylate

: 240494-70-6
metofluthrin

Conditions

Conditions	Yield
With lithium methanolate In n-heptane at 95 - 105℃; for 16h; Product distribution / selectivity; Heating / reflux;
With lithium methanolate In n-heptane at 95 - 105℃; for 17h; Product distribution / selectivity; Heating / reflux;

Raw Materials

40447-55-0

83282-91-1

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Specification

The Matofluthrin, with the CAS registry number 240494-70-6, is also known as [2,3,5,6-Tetrafluoro-4-(methoxymethyl)phenyl]methyl 2,2-dimethyl-3-pro p-1-enylcyclopropane-1-carboxylate. This chemical's molecular formula is C₁₈H₂₀F₄O₃ and formula weight is 360.35. What's more, both its systematic name and IUPAC name are the same which is called 2,3,5,6-Tetrafluoro-4-(methoxymethyl)benzyl 2,2-dimethyl-3-[(1Z)-prop-1-en-1-yl]cyclopropanecarboxylate.

Physical properties about this chemical are: (1)ACD/LogP: 5.26; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5; (4)ACD/LogD (pH 7.4): 5; (5)ACD/BCF (pH 5.5): 3143; (6)ACD/BCF (pH 7.4): 3143; (7)ACD/KOC (pH 5.5): 11092; (8)ACD/KOC (pH 7.4): 11092; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 7; (12)Polar Surface Area: 35.53 Å²; (13)Index of Refraction: 1.519; (14)Molar Refractivity: 85.61 cm³; (15)Molar Volume: 281.872 cm³; (16)Surface Tension: 39.852 dyne/cm; (17)Density: 1.278 g/cm³; (18)Flash Point: 152.023 °C; (19)Enthalpy of Vaporization: 57.949 kJ/mol; (20)Boiling Point: 336.342 °C at 760 mmHg; (21)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: C\C=C/C2C(C(=O)OCc1c(F)c(F)c(COC)c(F)c1F)C2(C)C
(2)InChI: InChI=1/C18H20F4O3/c1-5-6-11-12(18(11,2)3)17(23)25-8-10-15(21)13(19)9(7-24-4)14(20)16(10)22/h5-6,11-12H,7-8H2,1-4H3/b6-5-
(3)InChIKey: KVIZNNVXXNFLMU-WAYWQWQTBF