Dimethomorph

C₂₁H₂₂ClNO₄CAS 110488-70-5387.86 g/mol

Open in Covalent MOL file

Alkene Amide Aryl halide Ether

Properties

Molecular formula: C₂₁H₂₂ClNO₄
Molar mass: 387.86 g/mol
Exact mass: 387.1237 Da
Melting point: 127–148 °C
logP: 3.65Crippen estimate
Polar surface area: 48.0 Å²
H-bond donors / acceptors: 0 / 4
Rotatable bonds: 5

Hazards

Danger

H360F May damage fertilityReproductive toxicity
H411 Toxic to aquatic life with long lasting effectsHazardous to the aquatic environment, long-term hazard

Harmonised EU classification (CLP Annex VI), via PubChem.

Precautionary statements

P203, P273, P280, P318, P391, P405, P501

Identifiers

CAS number

110488-70-5

SMILES

COc1ccc(C(=CC(=O)N2CCOCC2)c2ccc(Cl)cc2)cc1OC

InChIKey

QNBTYORWCCMPQP-UHFFFAOYSA-N

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

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

11 names

2-Propen-1-one, 3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-(4-morpholinyl)-
Morpholine, 4-[3-(4-chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-oxo-2-propenyl]-
3-(4-Chlorophenyl)-3-(3,4-dimethoxyphenyl)-1-(4-morpholinyl)-2-propen-1-one
CME 151
Forum
Akrobat
Forum (biocide)
Festival C
Acrobat
Athlete
Xixianmalin

Work with Dimethomorph

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

(4-Hydroxy-3-methoxyphenyl)-4-morpholinylmethanethione17692-71-643 % similar 3,4-Dimethoxyacetophenone1131-62-041 % similar 3,4-Dimethoxybenzoyl chloride3535-37-340 % similar 2-[1-(4-Chlorobenzoyl)-5-methoxy-2-methyl-1H-indol-3-yl]-1-(4-morpholinyl)ethanone2854-32-239 % similar Propioveratrone1835-04-739 % similar 2-Bromo-1-(3,4-dimethoxyphenyl)ethanone1835-02-538 % similar 1-(5-Chloro-2-methoxyphenyl)ethanone6342-64-938 % similar Methyl 3,4-dimethoxybenzoate2150-38-138 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Palmatine chloride10605-02-4

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia