Chem
J-GLOBAL ID：200907013984474584
Nikkaji number：J2.024.642A
(E)-2-Methyl-4,4,4-trichloro-2-butenoic acid ethyl ester
(E)-2-メチル-4,4,4-トリクロロ-2-ブテン酸エチル
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： C7H9Cl3O2
Molecular formula furigana： C7-H9-CL3-O2
Molecular weight： 231.500
InChI：
InChI=1S/C7H9Cl3O2/c1-3-12-6(11)5(2)4-7(8,9)10/h4H,3H2,1-2H3/b5-4+
InChI key：
CODCZCFDGBGHIK-SNAWJCMRSA-N
SMILES：
CCOC(=O)/C(=C/C(Cl)(Cl)Cl)/C
Systematic name (3)：
- (E)-2-メチル-4,4,4-トリクロロ-2-ブテン酸エチル
- エチル (2E)-4,4,4-トリクロロ-2-メチルブタ-2-エノアート
- ethyl (2E)-4,4,4-trichloro-2-methylbut-2-enoate
- (E)-2-Methyl-4,4,4-trichloro-2-butenoic acid ethyl ester
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