rel-(1R,2S,4S)-3,3-Dimethylbicyclo[2.2.1]heptane-2-carboxylic acid

CAS Registry Number®

474-09-9
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CAS Name

rel-(1R,2S,4S)-3,3-Dimethylbicyclo[2.2.1]heptane-2-carboxylic acid

Molecular Formula

C10H16O2

Molecular Mass

168.23

Cite this Page

rel-(1R,2S,4S)-3,3-Dimethylbicyclo[2.2.1]heptane-2-carboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=474-09-9 (retrieved 2024-04-26) (CAS RN: 474-09-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    108-110 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1/C10H16O2/c1-10(2)7-4-3-6(5-7)8(10)9(11)12/h6-8H,3-5H2,1-2H3,(H,11,12)/t6-,7+,8-/s2

InChIKey

InChIKey=KJKODDSNIDHCKV-ZJTYPKPZNA-N

SMILES

C(O)(=O)[C@H]1[C@]2(C[C@@](C1(C)C)(CC2)[H])[H]

Canonical SMILES

O=C(O)C1C2CCC(C2)C1(C)C

Other Names for this Substance

  • Bicyclo[2.2.1]heptane-2-carboxylic acid, 3,3-dimethyl-, (1R,2S,4S)-rel-
  • 2-Norbornanecarboxylic acid, 3,3-dimethyl-, exo-
  • Bicyclo[2.2.1]heptane-2-carboxylic acid, 3,3-dimethyl-, exo-
  • rel-(1R,2S,4S)-3,3-Dimethylbicyclo[2.2.1]heptane-2-carboxylic acid
  • Isocamphenilanic acid

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Deleted or Replaced CAS Registry Numbers

28871-76-3, 67519-00-0

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