Chem
J-GLOBAL ID：200907025325721084
Nikkaji number：J2.024.637E
(E)-5,5,5-Trichloro-3-pentene-2-one
(E)-5,5,5-トリクロロ-3-ペンテン-2-オン
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
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
Molecular formula： C5H5Cl3O
Molecular formula furigana： C5-H5-CL3-O
Molecular weight： 187.440
InChI：
InChI=1S/C5H5Cl3O/c1-4(9)2-3-5(6,7)8/h2-3H,1H3/b3-2+
InChI key：
WYTWCHDMETZZSN-NSCUHMNNSA-N
SMILES：
CC(=O)/C=C/C(Cl)(Cl)Cl
Systematic name (3)：
- (E)-5,5,5-トリクロロ-3-ペンテン-2-オン
- (3E)-5,5,5-トリクロロペンタ-3-エン-2-オン
- (3E)-5,5,5-trichloropent-3-en-2-one
- (E)-5,5,5-Trichloro-3-pentene-2-one
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