Butylphthalide

CAS Registry Number®

6066-49-5

CAS Name

Butylphthalide

Molecular Formula

C12H14O2

Molecular Mass

190.24

Cite this Page

Butylphthalide.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=6066-49-5 (retrieved 2025-04-02) (CAS RN: 6066-49-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    114-116 °C @ Press: 0.15 Torr

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C12H14O2/c1-2-3-8-11-9-6-4-5-7-10(9)12(13)14-11/h4-7,11H,2-3,8H2,1H3

InChIKey

InChIKey=HJXMNVQARNZTEE-UHFFFAOYSA-N

SMILES

C(CCC)C1C=2C(C(=O)O1)=CC=CC2

Canonical SMILES

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

Other Names for this Substance

  • 1(3H)-Isobenzofuranone, 3-butyl-
  • Phthalide, 3-butyl-
  • 3-Butyl-1(3H)-isobenzofuranone
  • Butylphthalide
  • 3-n-Butylphthalide

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Deleted or Replaced CAS Registry Numbers

93133-67-6

CAS INSIGHTSTM
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