chempirical

Cyhalofop-butyl

C20H20FNO4CAS 122008-85-9357.38 g/mol

Open in Covalent MOL file
OOOONF
EsterHalogenNitrile

Properties

Molecular formula
C20H20FNO4
Molar mass
357.38 g/mol
Exact mass
357.1376 Da
logP
4.60Crippen estimate
Polar surface area
68.5 Ų
H-bond donors / acceptors
0 / 5
Rotatable bonds
8

Identifiers

CAS number
122008-85-9
SMILES
CCCCOC(=O)[C@@H](C)Oc1ccc(Oc2ccc(C#N)cc2F)cc1
InChIKey
TYIYMOAHACZAMQ-CQSZACIVSA-N
InChI
InChI=1S/C20H20FNO4/c1-3-4-11-24-20(23)14(2)25-16-6-8-17(9-7-16)26-19-10-5-15(13-22)12-18(19)21/h5-10,12,14H,3-4,11H2,1-2H3/t14-/m1/s1

Weigh it out

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

Names and synonyms

5 names
  • Propanoic acid, 2-[4-(4-cyano-2-fluorophenoxy)phenoxy]-, butyl ester, (2R)-
  • Propanoic acid, 2-[4-(4-cyano-2-fluorophenoxy)phenoxy]-, butyl ester, (R)-
  • XDE 537
  • Clincher
  • Clincher CA

Work with Cyhalofop-butyl

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

Same formula

(4S)-3-[(5S)-5-(4-Fluorophenyl)-5-hydroxy-1-oxopentyl]-4-phenyl-2-oxazolidinone189028-95-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook