Chem
J-GLOBAL ID：200907035962967297   Nikkaji number：J911C

Dehydroacetic acid sodium

デヒドロ酢酸ナトリウム
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： C8H7NaO4
Molecular formula furigana： C8-H7-NA-O4
Molecular weight： 190.130
InChI： InChI=1S/C8H8O4.Na/c1-4-3-6(10)7(5(2)9)8(11)12-4;/h3,10H,1-2H3;/q;+1/p-1
InChI key： ZPNRBQVNNIDJHX-UHFFFAOYSA-M
SMILES： CC(=O)c1c(O[Na])cc(C)oc1=O
Systematic name  (2)：
  • 3-アセチル-6-メチル-4-(ソジオオキシ)-2H-ピラン-2-オン
  • 3-acetyl-6-methyl-4-(sodiooxy)-2H-pyran-2-one
Other name (3)：
  • デヒドロ酢酸ナトリウム
  • Dehydroacetic acid sodium
  • 3-Acetyl-6-methyl-4-(sodiooxy)-2H-pyran-2-one
CAS registry number： 4418-26-2
Regulation number (4)：
  • EINECS2245801
  • UP8225000
  • (5)-665
  • TSCA(4418-26-2)
KEGG DRUG： D05856
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