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Phenamacril

CAT: 0931-T24214-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0931-T24214-01Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
39491-78-6
Target
Myosin, Antifungal
Related Pathways
Microbiology/Virology, Cytoskeletal Signaling
Purity
0.9952
Bioactivity
Phenamacril (JS39919) is acyanoacrylate fungicide, has powerful inhibition against Fusarium species, especially to Fusarium graminearum. Phenamacril is a specific Fusarium myosin I inhibitor.
Smiles
C(=C(\C(OCC)=O)/C#N)(\N)/C1=CC=CC=C1
Molecular Formula
C12H12N2O2
Molecular Weight
216.24
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Ethyl (2z)-3-amino-2-cyano-3-phenylprop-2-enoate
CAS Number39491-78-6
PubChem CID10632495
IUPAC Nameethyl (Z)-3-amino-2-cyano-3-phenylprop-2-enoate
Molecular FormulaC12H12N2O2
Molecular Weight216.24
XLogP2.2
Topological Polar Surface Area76.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count16
Formal Charge0
Complexity332
SMILES
CCOC(=O)/C(=C(/C1=CC=CC=C1)\N)/C#N
InChI
InChI=1S/C12H12N2O2/c1-2-16-12(15)10(8-13)11(14)9-6-4-3-5-7-9/h3-7H,2,14H2,1H3/b11-10-
InChIKey
YKRQBWKLHCEKQH-KHPPLWFESA-N
Chemical Structure
2D Structure
2D structure of Ethyl (2z)-3-amino-2-cyano-3-phenylprop-2-enoate
CAS: 39491-78-6
CID: 10632495
Formula: C12H12N2O2
MW: 216.24
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight216.24
XLogP32.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass216.089877630
Monoisotopic Mass216.089877630
Topological Polar Surface Area76.1 Ų
Heavy Atom Count16
Formal Charge0
Complexity332
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
PBA49178-01Phenamacril
HY-122200RPhenamacril (Standard)

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