Products for Research Use Only

Dimethomorph

CAT: 1459-CS-T-19504Size: 1 EachDry Ice: NoHazardous: No
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Description
Dimethomorph is listed under Pesticide Standards and is intended for analytical research, quality control and pharmaceutical reference standard applications. The product is supplied by Clearsynth under CAT No. CS-T-19504. Clearsynth provides this compound for research and analytical use, with product information including CAS number, molecular formula, molecular weight and product enquiry details.
Overview
Useful research chemical for a range of applications.
CAS Number
110488-70-5
Synonyms
Dimethomorph
Molecular Formula
C 21 H 22 ClNO 4
Molecular Weight
387.86
Additionnal Information
Dimethomorph is supplied with detailed characterization data compliant with regulatory guideline. Dimethomorph can be used for analytical method development, method validation (AMV), Quality Control (QC), ANDA-related analytical work, and commercial pharmaceutical research applications.
Storage Conditions
Refer MSDS for complete information.
Applications Notes
Useful research chemical for a range of applications.
HSN Code
38229010
Hazard Compound
Refer MSDS for accurate information.

Chemical Information

Dimethomorph

Dimethomorph is a fungicide effective against Oomycetes in vines, tomatoes and other crops with an systemic affect and good protective activity. It is also a lipid synthesis inhibitor.

CAS Number110488-70-5
PubChem CID86298
IUPAC Name3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-morpholin-4-ylprop-2-en-1-one
Molecular FormulaC21H22ClNO4
Molecular Weight387.9
XLogP3.9
Topological Polar Surface Area48
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count27
Formal Charge0
Complexity512
SMILES
COC1=C(C=C(C=C1)C(=CC(=O)N2CCOCC2)C3=CC=C(C=C3)Cl)OC
InChI
InChI=1S/C21H22ClNO4/c1-25-19-8-5-16(13-20(19)26-2)18(15-3-6-17(22)7-4-15)14-21(24)23-9-11-27-12-10-23/h3-8,13-14H,9-12H2,1-2H3
InChIKey
QNBTYORWCCMPQP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Dimethomorph
CAS: 110488-70-5
CID: 86298
Formula: C21H22ClNO4
MW: 387.9
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight387.9
XLogP33.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass387.1237359
Monoisotopic Mass387.1237359
Topological Polar Surface Area48 Ų
Heavy Atom Count27
Formal Charge0
Complexity512
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count1
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes