1,3-Adamantanedicarboxylic acid

CAS Registry Number®

39269-10-8

CAS Name

1,3-Adamantanedicarboxylic acid

Molecular Formula

C12H16O4

Molecular Mass

224.25

Cite this Page

1,3-Adamantanedicarboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=39269-10-8 (retrieved 2024-11-24) (CAS RN: 39269-10-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    279.5-280.5 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C12H16O4/c13-9(14)11-2-7-1-8(4-11)5-12(3-7,6-11)10(15)16/h7-8H,1-6H2,(H,13,14)(H,15,16)

InChIKey

InChIKey=PAVQGHWQOQZQEH-UHFFFAOYSA-N

SMILES

C(O)(=O)C12CC3(C(O)=O)CC(C1)CC(C2)C3

Canonical SMILES

O=C(O)C12CC3CC(C1)CC(C(=O)O)(C3)C2

Other Names for this Substance

  • Tricyclo[3.3.1.13,7]decane-1,3-dicarboxylic acid
  • 1,3-Adamantanedicarboxylic acid
  • 1,3-Dicarboxyadamantane

Deleted or Replaced CAS Registry Numbers

53263-87-9

CAS INSIGHTSTM
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