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Epsilon-Momfluorothrin

CAT: 1596-AR-M05047-01Size: 10 UnitsDry Ice: NoHazardous: No
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CAS Number
1065124-65-3
Molecular Formula
C19H19F4NO3
Molecular Weight
385.36
API Name
Momfluorothrin

Chemical Information

Momfluorothrin, (Z,1R,3R)-

Epsilon-momfluorothrin is a carboxylic ester obtained by formal condensation between the carboxy group of (1R,3R)-3-[(1Z)-2-cyanoprop-1-en-1-yl]-2,2-dimethylcyclopropane-1-carboxylic acid with the benzylic hydroxy group of [2,3,5,6-tetrafluoro-4-(methoxymethyl)phenyl]methanol. It has a role as an agrochemical and a pyrethroid ester insecticide. It is a nitrile, an ether, a carboxylic ester, an organofluorine insecticide, a member of cyclopropanes and a tetrafluorobenzene. It is functionally related to a chrysanthemic acid.

CAS Number1065124-65-3
PubChem CID25015075
IUPAC Namecis-[2,3,5,6-tetrafluoro-4-(methoxymethyl)phenyl]methyl (1R,3R)-3-[(Z)-2-cyanoprop-1-enyl]-2,2-dimethylcyclopropane-1-carboxylate
Molecular FormulaC19H19F4NO3
Molecular Weight385.4
XLogP3.2
Topological Polar Surface Area59.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count8
Rotatable Bond Count7
Heavy Atom Count27
Formal Charge0
Complexity628
SMILES
C/C(=C/[C@@H]1[C@H](C1(C)C)C(=O)OCC2=C(C(=C(C(=C2F)F)COC)F)F)/C#N
InChI
InChI=1S/C19H19F4NO3/c1-9(6-24)5-12-13(19(12,2)3)18(25)27-8-11-16(22)14(20)10(7-26-4)15(21)17(11)23/h5,12-13H,7-8H2,1-4H3/b9-5-/t12-,13+/m1/s1
InChIKey
DPJITPZADZSLBP-DQXQJKBJSA-N
Chemical Structure
2D Structure
2D structure of Momfluorothrin, (Z,1R,3R)-
CAS: 1065124-65-3
CID: 25015075
Formula: C19H19F4NO3
MW: 385.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight385.4
XLogP33.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count8
Rotatable Bond Count7
Exact Mass385.13010612
Monoisotopic Mass385.13010612
Topological Polar Surface Area59.3 Ų
Heavy Atom Count27
Formal Charge0
Complexity628
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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