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Home> Hot Product Listed R   > Rhodium,hydrotetrakis(phosphorous trifluoride-kP)- (9CI)
1215031-99-4 structure

Rhodium,hydrotetrakis(phosphorous trifluoride-kP)- (9CI)

Iupac Name:methyl 3-fluoro-5-hydroxy-4-methylbenzoate
CAS No.:1215031-99-4
Molecular Weight:184.166
Molecular Formula:FEH8O8S (isomer)
Names and Identifiers
Synonyms

Hydrotetrakis(trifluorophosphine)rhodium Phosphorous trifluoride, rhodiumcomplex Rhodium,hydrotetrakis(phosphorus trifluoride)- (8CI)

Inchi
InChI=1S/C9H9FO3/c1-5-7(10)3-6(4-8(5)11)9(12)13-2/h3-4,11H,1-2H3
InChkey
XGUDTZGRCCTTMQ-UHFFFAOYSA-N
Canonical Smiles
CC1=C(C=C(C=C1F)C(=O)OC)O
Computational chemical data
  • Molecular Weight:184.166g/mol
  • Molecular Formula:FEH8O8S
  • Compound Is Canonicalized:True
  • Exact Mass:184.054
  • Monoisotopic Mass:184.054
  • Complexity:195
  • Rotatable Bond Count:2
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:4
  • Topological Polar Surface Area:46.5A^2
  • Heavy Atom Count:13
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
  • CACTVS Substructure Key Fingerprint: AAADccBwMQAAAAAAAAAAAAAAAAAAAAAAAAAwAAAAAAAAAAABAAAAGwAACAAADASAmAoyDoAABgCI AiDSCAACAAAkIAAAiAEGCMgIJjKCNRqAcQAkwBEIuYfKyDCOQAABAAAIAACAAAIAABAAAAAAAAAA AA==
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