Chem
J-GLOBAL ID:200907026044375442   Nikkaji number:J2.552.411J

2-[(1E,3E)-4-Chloro-1,3-butadienyl]-6-methyl-1,3-dioxa-2-bora-6-azacyclooctane-4,8-dione

2-[(1E,3E)-4-クロロブタ-1,3-ジエン-1-イル]-6-メチル-1,3,6,2-ジオキサザボロカン-4,8-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: C9H11BClNO4
Molecular formula furigana: C9-H11-B-CL-N-O4
Molecular weight: 243.450
InChI: InChI=1S/C9H11BClNO4/c1-12-6-8(13)15-10(4-2-3-5-11)16-9(14)7-12/h2-5H,6-7H2,1H3/b4-2+,5-3+
InChI key: NXZCWXGCVLJEGU-ZUVMSYQZSA-N
SMILES: CN1CC(=O)OB(OC(=O)C1)/C=C/C=C/Cl
Systematic name  (3):
  • 2-[(1E,3E)-4-クロロ-1,3-ブタジエニル]-6-メチル-1,3-ジオキサ-2-ボラ-6-アザシクロオクタン-4,8-ジオン
  • 2-[(1E,3E)-4-クロロブタ-1,3-ジエン-1-イル]-6-メチル-1,3,6,2-ジオキサザボロカン-4,8-ジオン
  • 2-[(1E,3E)-4-chlorobuta-1,3-dien-1-yl]-6-methyl-1,3,6,2-dioxazaborocane-4,8-dione
Other name (1):
  • 2-[(1E,3E)-4-Chloro-1,3-butadienyl]-6-methyl-1,3-dioxa-2-bora-6-azacyclooctane-4,8-dione
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