3-Bromophthalide

CAS Registry Number®

6940-49-4
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CAS Name

3-Bromophthalide

Molecular Formula

C8H5BrO2

Molecular Mass

213.03

Cite this Page

3-Bromophthalide.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=6940-49-4 (retrieved 2024-06-26) (CAS RN: 6940-49-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    114-116 °C @ Press: 0.3 Torr

  • Melting Point (2)

    78 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C8H5BrO2/c9-7-5-3-1-2-4-6(5)8(10)11-7/h1-4,7H

InChIKey

InChIKey=CLMSHAWYULIVFQ-UHFFFAOYSA-N

SMILES

BrC1C=2C(C(=O)O1)=CC=CC2

Canonical SMILES

O=C1OC(Br)C=2C=CC=CC12

Other Names for this Substance

  • 1(3H)-Isobenzofuranone, 3-bromo-
  • Phthalide, 3-bromo-
  • 1(3H)-Isobenzofuranone, 3-bromo-, (±)-
  • 3-Bromo-1(3H)-isobenzofuranone
  • Phthalidyl bromide

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Deleted or Replaced CAS Registry Numbers

75289-01-9