[1,1′-Biphenyl]-4-carboxylic acid, (3aR,4S,5R,6aS)-hexahydro-4-(hydroxymethyl)-2-oxo-2H-cyclopenta[b]furan-5-yl ester

CAS Registry Number®

31752-99-5
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CAS Name

[1,1′-Biphenyl]-4-carboxylic acid, (3aR,4S,5R,6aS)-hexahydro-4-(hydroxymethyl)-2-oxo-2H-cyclopenta[b]furan-5-yl ester

Molecular Formula

C21H20O5

Molecular Mass

352.38

Cite this Page

[1,1′-Biphenyl]-4-carboxylic acid, (3aR,4S,5R,6aS)-hexahydro-4-(hydroxymethyl)-2-oxo-2H-cyclopenta[b]furan-5-yl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=31752-99-5 (retrieved 2024-04-28) (CAS RN: 31752-99-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    130.5-132 °C

Source(s)

Other Names and Identifiers

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

InChIKey=SZJVIFMPKWMGSX-AKHDSKFASA-N

SMILES

C(O)[C@@H]1[C@@]2([C@](C[C@H]1OC(=O)C3=CC=C(C=C3)C4=CC=CC=C4)(OC(=O)C2)[H])[H]

Canonical SMILES

O=C(OC1CC2OC(=O)CC2C1CO)C=3C=CC(=CC3)C=4C=CC=CC4

Other Names for this Substance

  • [1,1′-Biphenyl]-4-carboxylic acid, (3aR,4S,5R,6aS)-hexahydro-4-(hydroxymethyl)-2-oxo-2H-cyclopenta[b]furan-5-yl ester
  • [1,1′-Biphenyl]-4-carboxylic acid, hexahydro-4-(hydroxymethyl)-2-oxo-2H-cyclopenta[b]furan-5-yl ester, [3aR-(3aα,4α,5β,6aα)]-
  • 4-Biphenylcarboxylic acid, 5-ester with 3,3aα,4,5,6,6aα-hexahydro-5β-hydroxy-4α-(hydroxymethyl)-2H-cyclopenta[b]furan-2-one, (-)-
  • 2H-Cyclopenta[b]furan, [1,1′-biphenyl]-4-carboxylic acid deriv.
  • (-)-Corey lactone

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Deleted or Replaced CAS Registry Numbers

57820-67-4

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