Chem
J-GLOBAL ID：201007080174768573
Nikkaji number：J2.783.846D
3,4,6-Trichloro-3,5-cyclohexadiene-1α,2α-diol
3,4,6-トリクロロ-3,5-シクロヘキサジエン-1α,2α-ジオール
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： C6H5Cl3O2
Molecular formula furigana： C6-H5-CL3-O2
Molecular weight： 215.450
InChI：
InChI=1S/C6H5Cl3O2/c7-2-1-3(8)5(10)6(11)4(2)9/h1,5-6,10-11H/t5-,6+/m0/s1
InChI key：
REPDFJGEZLAWCC-NTSWFWBYSA-N
SMILES：
O[C@@H]1[C@H](O)C(=C(Cl)C=C1Cl)Cl
Systematic name (3)：
- 3,4,6-トリクロロ-3,5-シクロヘキサジエン-1α,2α-ジオール
- (1R,2S)-3,4,6-トリクロロシクロヘキサ-3,5-ジエン-1,2-ジオール
- (1R,2S)-3,4,6-trichlorocyclohexa-3,5-diene-1,2-diol
- 3,4,6-Trichloro-3,5-cyclohexadiene-1α,2α-diol
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