374726-62-2
Product Name:
Mandipropamid
Formula:
C23H22ClNO4
Synonyms:
2-(4-Chlorophenyl)-N-[3-methoxy-4-(2-propynyloxy)phenethyl]-2-(2-propynyloxy)acetamide
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Color/Form | Light beige powder |
|---|---|
| Melting Point | 96.4-97.3 °C |
| Solubility | Solubilities (g/L, 25 °C): n-hexane 0.042, n-octanol 4.8, toluene 29, methanol 66, ethyl acetate 120, acetone 300, dichloromethane 400 |
| Density | 1.24 at 22 °C |
| Vapor Pressure | <9.4X10-4 mPa (25-50 °C) /SRC: 7.1X10-9 mm Hg/ |
| LogP | log Kow = 3.2 |
| pH | pH 6-8 at 25 °C (1% aqueous dispersion) |
| Dissociation Constants | No dissociation constant in the pH range of 1 to 12 |
| Collision Cross Section | 195.15 Ų [M+H]+ [CCS Type: TW] |
| Other Experimental Properties | Stable to hydrolysis at pH 4-9 |
SAFETY INFORMATION
| Signal word | Warning |
|---|---|
| Pictogram(s) |
 Environment GHS09 |
| GHS Hazard Statements |
H410:Hazardous to the aquatic environment, long-term hazard |
| Precautionary Statement Codes |
P273:Avoid release to the environment. P391:Collect spillage. Hazardous to the aquatic environment P501:Dispose of contents/container to..… |
COMPUTED DESCRIPTORS
| Molecular Weight | 411.9 g/mol |
|---|---|
| XLogP3 | 3.9 |
| Hydrogen Bond Donor Count | 1 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 10 |
| Exact Mass | 411.1237359 g/mol |
| Monoisotopic Mass | 411.1237359 g/mol |
| Topological Polar Surface Area | 56.8 Ų |
| Heavy Atom Count | 29 |
| Formal Charge | 0 |
| Complexity | 599 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
2-(4-chlorophenyl)-N-{2-[3-methoxy-4-(prop-2-yn-1-yloxy)phenyl]ethyl}-2-(prop-2-yn-1-yloxy)acetamide is a monocarboxylic acid amide resulting from the condensation of the carboxy group of p-chloromandelic acid propargyl ether with the amino group of 2-[3-methoxy-4-(prop-2-yn-1-yloxy)phenyl]ethylamine. It is a monocarboxylic acid amide, a terminal acetylenic compound, an aromatic ether and a member of monochlorobenzenes.