Chem
J-GLOBAL ID：200907001708492317   Nikkaji number：J520.560C

2-Pentenedioic acid 1-neopentyl ester

2-ペンテン二酸1-ネオペンチル
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： C10H16O4
Molecular formula furigana： C10-H16-O4
Molecular weight： 200.234
InChI： InChI=1S/C10H16O4/c1-10(2,3)7-14-9(13)6-4-5-8(11)12/h4,6H,5,7H2,1-3H3,(H,11,12)
InChI key： GRDRHAJLKNCLEF-UHFFFAOYSA-N
SMILES： CC(C)(C)COC(=O)C=CCC(=O)O
Systematic name  (3)：
  • 2-ペンテン二酸1-ネオペンチル
  • 5-(2,2-ジメチルプロポキシ)-5-オキソペンタ-3-エン酸
  • 5-(2,2-dimethylpropoxy)-5-oxopent-3-enoic acid
Other name (1)：
  • 2-Pentenedioic acid 1-neopentyl ester
Regulation number (1)：
  • (2)-1142
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