3,3-Dimethylphthalide
CAS Registry Number®
1689-09-4
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CAS Name
3,3-DimethylphthalideMolecular Formula
C10H10O2Molecular Mass
162.19Cite this Page
3,3-Dimethylphthalide. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=1689-09-4 (retrieved ) (CAS RN: 1689-09-4). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Compound Properties
Boiling Point (1)
96-97 °C @ Press: 0.1 TorrMelting Point (2)
68 °C
Source(s)
Other Names and Identifiers
InChI
InChI=1S/C10H10O2/c1-10(2)8-6-4-3-5-7(8)9(11)12-10/h3-6H,1-2H3
InChIKey
InChIKey=YFBZUWUJSCLVST-UHFFFAOYSA-N
SMILES
CC1(C)C=2C(C(=O)O1)=CC=CC2
Canonical SMILES
O=C1OC(C=2C=CC=CC12)(C)C
Other Names for this Substance
- 1(3H)-Isobenzofuranone, 3,3-dimethyl-
- Phthalide, 3,3-dimethyl-
- 3,3-Dimethyl-1(3H)-isobenzofuranone
- 3,3-Dimethylphthalide
- NSC 5114
