Chem
J-GLOBAL ID：200907068817148631   Nikkaji number：J1.872.074D

1-Octyl-5-ethynylpyrimidine 2,4(1H,3H)-dione

1-オクチル-5-エチニルピリミジン2,4(1H,3H)-ジオン
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： C14H20N2O2
Molecular formula furigana： C14-H20-N2-O2
Molecular weight： 248.326
InChI： InChI=1S/C14H20N2O2/c1-3-5-6-7-8-9-10-16-11-12(4-2)13(17)15-14(16)18/h2,11H,3,5-10H2,1H3,(H,15,17,18)
InChI key： QXCJNBUAXFDYKZ-UHFFFAOYSA-N
SMILES： CCCCCCCCn1cc(C#C)c(=O)[nH]c1=O
Systematic name  (4)：
  • 5-エチニル-1-オクチルピリミジン-2,4(1H,3H)-ジオン
  • 1-オクチル-5-エチニルピリミジン2,4(1H,3H)-ジオン
  • 5-エチニル-1-オクチル-1,2,3,4-テトラヒドロピリミジン-2,4-ジオン
  • 5-ethynyl-1-octyl-1,2,3,4-tetrahydropyrimidine-2,4-dione
Other name (2)：
  • 5-Ethynyl-1-octylpyrimidine-2,4(1H,3H)-dione
  • 1-Octyl-5-ethynylpyrimidine 2,4(1H,3H)-dione
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