4-(1,3-Benzodioxol-5-yl)-4,6,7,8-tetrahydro-7,7-dimethyl-2H-1-benzopyran-2,5(3H)-dione

CAS Registry Number®

369587-56-4
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CAS Name

4-(1,3-Benzodioxol-5-yl)-4,6,7,8-tetrahydro-7,7-dimethyl-2H-1-benzopyran-2,5(3H)-dione

Molecular Formula

C18H18O5

Molecular Mass

314.33

Cite this Page

4-(1,3-Benzodioxol-5-yl)-4,6,7,8-tetrahydro-7,7-dimethyl-2H-1-benzopyran-2,5(3H)-dione.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=369587-56-4 (retrieved 2024-08-25) (CAS RN: 369587-56-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    154-156 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C18H18O5/c1-18(2)7-12(19)17-11(6-16(20)23-15(17)8-18)10-3-4-13-14(5-10)22-9-21-13/h3-5,11H,6-9H2,1-2H3

InChIKey

InChIKey=FQJOJPJVIILVRF-UHFFFAOYSA-N

SMILES

O=C1C=2C(CC(=O)OC2CC(C)(C)C1)C=3C=C4C(=CC3)OCO4

Canonical SMILES

O=C1OC2=C(C(=O)CC(C)(C)C2)C(C3=CC=C4OCOC4=C3)C1

Other Names for this Substance

  • 2H-1-Benzopyran-2,5(3H)-dione, 4-(1,3-benzodioxol-5-yl)-4,6,7,8-tetrahydro-7,7-dimethyl-
  • 4-(1,3-Benzodioxol-5-yl)-4,6,7,8-tetrahydro-7,7-dimethyl-2H-1-benzopyran-2,5(3H)-dione
  • 4-(3,4-Methylenedioxyphenyl)-7,7-dimethyl-5-oxo-3,4,5,6,7,8-hexahydrocoumarin