Chem
J-GLOBAL ID:200907045231833688   Nikkaji number:J1.079.825F

3-(4-Chlorophenyl)-3aα,5,6,6aα-tetrahydro-4H-cyclopenta[d]isoxazole-4α-ol

3-(4-クロロフェニル)-3aα,5,6,6aα-テトラヒドロ-4H-シクロペンタ[d]イソオキサゾール-4α-オール
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: C12H12ClNO2
Molecular formula furigana: C12-H12-CL-N-O2
Molecular weight: 237.680
InChI: InChI=1S/C12H12ClNO2/c13-8-3-1-7(2-4-8)12-11-9(15)5-6-10(11)16-14-12/h1-4,9-11,15H,5-6H2/t9-,10-,11+/m1/s1
InChI key: VDKOEIFPNZUBRR-MXWKQRLJSA-N
SMILES: O[C@@H]1CC[C@H]2ON=C([C@@H]12)c1ccc(Cl)cc1
Systematic name  (3):
  • 3-(4-クロロフェニル)-3aα,5,6,6aα-テトラヒドロ-4H-シクロペンタ[d]イソオキサゾール-4α-オール
  • (3aS,4R,6aR)-3-(4-クロロフェニル)-3aH,4H,5H,6H,6aH-シクロペンタ[d][1,2]オキサゾール-4-オール
  • (3aS,4R,6aR)-3-(4-chlorophenyl)-3aH,4H,5H,6H,6aH-cyclopenta[d][1,2]oxazol-4-ol
Other name (1):
  • 3-(4-Chlorophenyl)-3aα,5,6,6aα-tetrahydro-4H-cyclopenta[d]isoxazole-4α-ol
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