Chem
J-GLOBAL ID：200907089791230765   Nikkaji number：J405.523C

Levoglucosenone

レボグルコセノン
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C6H6O3
Molecular formula furigana： C6-H6-O3
Molecular weight： 126.111
InChI： InChI=1S/C6H6O3/c7-5-2-1-4-3-8-6(5)9-4/h1-2,4,6H,3H2/t4-,6+/m0/s1
InChI key： HITOXZPZGPXYHY-UJURSFKZSA-N
SMILES： O=C1C=C[C@H]2CO[C@@H]1O2
Systematic name  (8)：
  • (1S,5R)-6,8-ジオキサビシクロ[3.2.1]オクタ-2-エン-4-オン
  • (2R)-2β,6β-(エポキシメタノ)-3,6-ジヒドロ-2H-ピラン-3-オン
  • (2R,6S)-2,6-エポキシ-6,7-ジヒドロオキセピン-3(2H)-オン
  • (1β,5β)-6,8-ジオキサビシクロ[3.2.1]オクタ-2-エン-4-オン
  • 2β,6β-(エポキシメタノ)-2H-ピラン-3(6H)-オン
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Other name (11)：
  • レボグルコセノン
  • Levoglucosenone
  • (1S,5R)-6,8-Dioxabicyclo[3.2.1]oct-2-en-4-one
  • (2R)-2β,6β-(Epoxymethano)-3,6-dihydro-2H-pyran-3-one
  • (2R,6S)-2,6-Epoxy-6,7-dihydrooxepin-3(2H)-one
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CAS registry number： 37112-31-5
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