3-Bromophthalide
CAS Registry Number®
6940-49-4
CAS Name
3-BromophthalideMolecular Formula
C8H5BrO2Molecular Mass
213.03Cite 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 ) (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 TorrMelting Point (2)
78 °C
Source(s)
- (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.
- (2) Reichel, L.; Zeitschrift fuer Chemie, (1963), 3, 190, CAplus
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
Deleted or Replaced CAS Registry Numbers
75289-01-9
