283159-90-0
Product Name:
valiphenal
Formula:
C19H27ClN2O5
Synonyms:
N-[(1-Methylethoxy)carbonyl]-L -valyl-3-(4-chlorophenyl)-β-alanine methyl ester;Methyl N-(isopropoxycarbonyl)-L -valyl-(3RS)-3-(4-chlorophenyl)-β-alaninate
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
| Collision Cross Section | 208.44 Ų [M-H]- 206.93 Ų [M+Cl]- 208.51 Ų [M+HCOO]- 208.16 Ų [M+HCOO]- 208.43 Ų [M-H]- 207.08 Ų [M+Cl]- |
|---|
COMPUTED DESCRIPTORS
| Molecular Weight | 398.9 g/mol |
|---|---|
| XLogP3 | 3.4 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 10 |
| Exact Mass | 398.1608497 g/mol |
| Monoisotopic Mass | 398.1608497 g/mol |
| Topological Polar Surface Area | 93.7 Ų |
| Heavy Atom Count | 27 |
| Formal Charge | 0 |
| Complexity | 504 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 1 |
| 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
Valifenalate is a diastereoisomeric mixture of L-(R)- and L-(S)-valifenalate. An anti-peronosporic fungicide, it is used to control mildew in many crops including grapes, potatoes and tomatoes. It has a role as an antifungal agrochemical. It is a diastereoisomeric mixture and an acylamino acid fungicide. It contains a L-(R)-valifenalate and a L-(S)-valifenalate.