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Enoxastrobin

CAT: 0931-T19951-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T19951-01Size:25 mg
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CAS Number
238410-11-2
Target
Antifungal, Others
Related Pathways
Microbiology/Virology, Others
Bioactivity
Enoxastrobin is a reagent biochemical.
Smiles
C(\C(OC)=O)(=C/OC)/C1=C(CO/N=C(/C=C/C2=CC=C(Cl)C=C2)\C)C=CC=C1
Molecular Formula
C22H22ClNO4
Molecular Weight
399.87
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Enoxastrobin

Enoxastrobin is an enoate ester that is the methyl ester of (2E)-2-{2-[({(E)-[(3E)-4-(4-chlorophenyl)but-3-en-2-ylidene]amino}oxy)methyl]phenyl}-3-methoxyprop-2-enoic acid. A fungicide used for control of leaf blotch, leaf rust and powdery mildew on wheat and other fungal diseases on cucumbers, tomatoes and grapes. It has a role as a mitochondrial cytochrome-bc1 complex inhibitor and an antifungal agrochemical. It is a methyl ester, an oxime O-ether, an enol ether, an enoate ester, a member of monochlorobenzenes and a methoxyacrylate strobilurin antifungal agent.

CAS Number238410-11-2
PubChem CID59649244
IUPAC Namemethyl (E)-2-[2-[[(E)-[(E)-4-(4-chlorophenyl)but-3-en-2-ylidene]amino]oxymethyl]phenyl]-3-methoxyprop-2-enoate
Molecular FormulaC22H22ClNO4
Molecular Weight399.9
XLogP4.8
Topological Polar Surface Area57.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count9
Heavy Atom Count28
Formal Charge0
Complexity579
SMILES
C/C(=N\OCC1=CC=CC=C1/C(=C\OC)/C(=O)OC)/C=C/C2=CC=C(C=C2)Cl
InChI
InChI=1S/C22H22ClNO4/c1-16(8-9-17-10-12-19(23)13-11-17)24-28-14-18-6-4-5-7-20(18)21(15-26-2)22(25)27-3/h4-13,15H,14H2,1-3H3/b9-8+,21-15+,24-16+
InChIKey
VMNULHCTRPXWFJ-UJSVPXBISA-N
Chemical Structure
2D Structure
2D structure of Enoxastrobin
CAS: 238410-11-2
CID: 59649244
Formula: C22H22ClNO4
MW: 399.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight399.9
XLogP34.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count9
Exact Mass399.1237359
Monoisotopic Mass399.1237359
Topological Polar Surface Area57.1 Ų
Heavy Atom Count28
Formal Charge0
Complexity579
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count3
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
MBS5772222Enoxastrobin

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