chempirical

Sethoxydim

C17H29NO3SCAS 74051-80-2327.48 g/mol

Open in Covalent MOL file
NOHOSO
AlkeneKetoneOximeSulfide

Properties

Molecular formula
C17H29NO3S
Molar mass
327.48 g/mol
Exact mass
327.1868 Da
Melting point
below 25 °C
logP
4.50Crippen estimate
Polar surface area
58.9 Ų
H-bond donors / acceptors
1 / 5
Rotatable bonds
9

Identifiers

CAS number
74051-80-2
SMILES
CCCC(=NOCC)C1=C(O)CC(CC(C)SCC)CC1=O
InChIKey
CSPPKDPQLUUTND-UHFFFAOYSA-N
InChI
InChI=1S/C17H29NO3S/c1-5-8-14(18-21-6-2)17-15(19)10-13(11-16(17)20)9-12(4)22-7-3/h12-13,19H,5-11H2,1-4H3

Weigh it out

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

Names and synonyms

21 names · show all
  • 2-Cyclohexen-1-one, 2-[1-(ethoxyimino)butyl]-5-[2-(ethylthio)propyl]-3-hydroxy-
  • 2-[1-(Ethoxyimino)butyl]-5-[2-(ethylthio)propyl]-3-hydroxy-2-cyclohexen-1-one
  • BAS 9052
  • NP 55
  • Cyethoxydim
  • Poast
  • BAS 90520H
  • ARD 34/02
  • Nabu
  • Alloxol S
  • Expand
  • BASF 9052
  • Nabu S
  • Expand plus
  • Fervinal
  • Grasidim
  • Poast plus
  • Fervinal plus
  • Sertin
  • Segment
  • 2-(1-(Ethoxyimino)butyl)-5-(2-(ethylthio)propyl)-3-hydroxycyclohex-2-enone

Work with Sethoxydim

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

Clethodim99129-21-263 % similar Tralkoxydim87820-88-039 % similar

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

Elsewhere

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