Chem
J-GLOBAL ID：200907099724304814
Nikkaji number：J393.213C
(1R,4R)-2-(Trifluoromethyl)bicyclo[2.2.1]hept-5-ene-2β-carboxylic acid
(1R,4R)-2-(トリフルオロメチル)ビシクロ[2.2.1]ヘプタ-5-エン-2β-カルボン酸
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： C9H9F3O2
Molecular formula furigana： C9-H9-F3-O2
Molecular weight： 206.164
InChI：
InChI=1S/C9H9F3O2/c10-9(11,12)8(7(13)14)4-5-1-2-6(8)3-5/h1-2,5-6H,3-4H2,(H,13,14)/t5-,6+,8-/m1/s1
InChI key：
IVQQRSCSISNRNA-GKROBHDKSA-N
SMILES：
OC(=O)[C@]1(C[C@H]2C[C@@H]1C=C2)C(F)(F)F
Systematic name (3)：
- (1R,4R)-2-(トリフルオロメチル)ビシクロ[2.2.1]ヘプタ-5-エン-2β-カルボン酸
- (1R,2R,4R)-2-(トリフルオロメチル)ビシクロ[2.2.1]ヘプタ-5-エン-2-カルボン酸
- (1R,2R,4R)-2-(trifluoromethyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
- (1R,4R)-2-(Trifluoromethyl)bicyclo[2.2.1]hept-5-ene-2β-carboxylic acid
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