1-Pyrenebutanoic acid

CAS Registry Number®

3443-45-6
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CAS Name

1-Pyrenebutanoic acid

Molecular Formula

C20H16O2

Molecular Mass

288.34

Cite this Page

1-Pyrenebutanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=3443-45-6 (retrieved 2024-04-20) (CAS RN: 3443-45-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    185-186 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C20H16O2/c21-18(22)6-2-3-13-7-8-16-10-9-14-4-1-5-15-11-12-17(13)20(16)19(14)15/h1,4-5,7-12H,2-3,6H2,(H,21,22)

InChIKey

InChIKey=QXYRRCOJHNZVDJ-UHFFFAOYSA-N

SMILES

C(CCC(O)=O)C1=C2C3=C4C(C=C2)=CC=CC4=CC=C3C=C1

Canonical SMILES

O=C(O)CCCC1=CC=C2C=CC3=CC=CC=4C=CC1=C2C34

Other Names for this Substance

  • 1-Pyrenebutanoic acid
  • 1-Pyrenebutyric acid
  • γ-(3-Pyrenyl)butyric acid
  • Pyrene-3-butyric acid
  • 1-Pyrenylbutyric acid

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Deleted or Replaced CAS Registry Numbers

1263096-99-6

CAS INSIGHTSTM
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