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Pyrametostrobin

CAT: 0926-QLB41070-03Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0926-QLB41070-03Size:25 mg
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CAS Number
915410-70-7
Smiles
C1=CC (=CC (=C1) F) C2=CSC (=N2) NN
Molecular Formula
C21H23N3O4
Molecular Weight
381.4 g/mol
Controlled
No

Chemical Information

Pyrametostrobin

Pyrametostrobin is a carbamate ester that is the methyl ester of (2-{[(1,4-dimethyl-3-phenyl-1H-pyrazol-5-yl)oxy]methyl}phenyl)methoxycarbamic acid. A fungicide that is active against powdery mildew and other diseases. It has a role as a mitochondrial cytochrome-bc1 complex inhibitor and an antifungal agrochemical. It is a carbamate ester, a member of pyrazoles, an aromatic ether, a methoxycarbanilate strobilurin antifungal agent and a carbanilate fungicide.

CAS Number915410-70-7
PubChem CID45381137
IUPAC Namemethyl N-[2-[(1,4-dimethyl-3-phenylpyrazol-5-yl)oxymethyl]phenyl]-N-methoxycarbamate
Molecular FormulaC21H23N3O4
Molecular Weight381.4
XLogP3.9
Topological Polar Surface Area65.8
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Heavy Atom Count28
Formal Charge0
Complexity500
SMILES
CC1=C(N(N=C1C2=CC=CC=C2)C)OCC3=CC=CC=C3N(C(=O)OC)OC
InChI
InChI=1S/C21H23N3O4/c1-15-19(16-10-6-5-7-11-16)22-23(2)20(15)28-14-17-12-8-9-13-18(17)24(27-4)21(25)26-3/h5-13H,14H2,1-4H3
InChIKey
DWTVBEZBWMDXIY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Pyrametostrobin
CAS: 915410-70-7
CID: 45381137
Formula: C21H23N3O4
MW: 381.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight381.4
XLogP33.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Exact Mass381.16885622
Monoisotopic Mass381.16885622
Topological Polar Surface Area65.8 Ų
Heavy Atom Count28
Formal Charge0
Complexity500
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
463235Pyrametostrobin
463236-01Pyrametostrobin-D3

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