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(3Ar,4S,5R,6As)-4-(Hydroxymethyl)-2-Oxohexahydro-2H-Cyclopenta[B]Furan-5-Yl Biphenyl-4-Carboxylate

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Catalog Number ACM31752995-1
CAS 31752-99-5
Structure {[CurrentData.Name]}
IUPAC Name [(3aR,4S,5R,6aS)-4-(hydroxymethyl)-2-oxo-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-5-yl] 4-phenylbenzoate
Synonyms 4-(Hydroxymethyl)-2-Oxohexahydro-2H-Cyclopenta[B]Furan-5-Yl 4-Biphenylcarboxylate
Molecular Weight 352.38
Molecular Formula C21H20O5
Canonical SMILES C1[C@H]2[C@H](CC(=O)O2)[C@H]([C@@H]1OC(=O)C3=CC=C(C=C3)C4=CC=CC=C4)CO
Inchi InChI=1S/C21H20O5/c22-12-17-16-10-20(23)25-18(16)11-19(17)26-21(24)15-8-6-14(7-9-15)13-4-2-1-3-5-13/h1-9,16-19,22H,10-12H2/t16-,17-,18+,19-/m1/s1
InChIKey SZJVIFMPKWMGSX-AKHDSKFASA-N
Boiling Point 584.8 °C at 760 mmHg
Melting Point 131-132 °C(lit.)
Flash Point 210.6±22.2 °C
Purity 98%
Density 1.3±0.1 g/cm3
Appearance Off-white to pale yellow solid
Refractive Index 1.629

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