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2-Propyl-3-hydroxy-6-methyl-4H-pyran-4-one

Base Information
  • Chemical Name:2-Propyl-3-hydroxy-6-methyl-4H-pyran-4-one
  • CAS No.:40861-87-8
  • Molecular Formula:C9H12O3
  • Molecular Weight:168.192
  • Hs Code.:
  • DSSTox Substance ID:DTXSID50879546
  • Nikkaji Number:J771.807A
  • Wikidata:Q82861657
  • ChEMBL ID:CHEMBL123932
2-Propyl-3-hydroxy-6-methyl-4H-pyran-4-one

Synonyms:40861-87-8;CHEMBL123932;SCHEMBL8397201;DTXSID50879546;4H-Pyran-4-one, 2-Pr-3-hydroxy-6-Me-;2-Propyl-3-hydroxy-6-methyl-4H-pyran-4-one

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Chemical Property of 2-Propyl-3-hydroxy-6-methyl-4H-pyran-4-one
Chemical Property:
  • XLogP3:1.5
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:3
  • Rotatable Bond Count:2
  • Exact Mass:168.078644241
  • Heavy Atom Count:12
  • Complexity:261
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MSDS Files:
Useful:
  • Canonical SMILES:CCCC1=C(C(=O)C=C(O1)C)O
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