9-Chloro-3,4-dihydro-8,13-dihydroxy-2,2,5,10-tetramethyl-4,11-dioxo-2H,11H-[1,4]benzodioxepino[2,3-g]-1-benzopyran-7-carboxaldehyde

CAS Registry Number®

68455-12-9
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CAS Name

9-Chloro-3,4-dihydro-8,13-dihydroxy-2,2,5,10-tetramethyl-4,11-dioxo-2H,11H-[1,4]benzodioxepino[2,3-g]-1-benzopyran-7-carboxaldehyde

Molecular Formula

C21H17ClO8

Molecular Mass

432.81

Cite this Page

9-Chloro-3,4-dihydro-8,13-dihydroxy-2,2,5,10-tetramethyl-4,11-dioxo-2H,11H-[1,4]benzodioxepino[2,3-g]-1-benzopyran-7-carboxaldehyde.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=68455-12-9 (retrieved 2024-07-01) (CAS RN: 68455-12-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    256-257 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C21H17ClO8/c1-7-12-17(9(6-23)14(25)13(7)22)28-16-8(2)11-10(24)5-21(3,4)30-18(11)15(26)19(16)29-20(12)27/h6,25-26H,5H2,1-4H3

InChIKey

InChIKey=BUWVABSQGVRXOI-UHFFFAOYSA-N

SMILES

C(=O)C1=C2C(C(=O)OC=3C(O2)=C(C)C4=C(C3O)OC(C)(C)CC4=O)=C(C)C(Cl)=C1O

Canonical SMILES

O=CC1=C(O)C(Cl)=C(C=2C(=O)OC=3C(O)=C4OC(C)(C)CC(=O)C4=C(C3OC12)C)C

Other Names for this Substance

  • 2H,11H-[1,4]Benzodioxepino[2,3-g]-1-benzopyran-7-carboxaldehyde, 9-chloro-3,4-dihydro-8,13-dihydroxy-2,2,5,10-tetramethyl-4,11-dioxo-
  • 2H,11H-1-Benzopyrano[6,7-b][1,4]benzodioxepin-7-carboxaldehyde, 9-chloro-3,4-dihydro-8,13-dihydroxy-2,2,5,10-tetramethyl-4,11-dioxo-
  • 9-Chloro-3,4-dihydro-8,13-dihydroxy-2,2,5,10-tetramethyl-4,11-dioxo-2H,11H-[1,4]benzodioxepino[2,3-g]-1-benzopyran-7-carboxaldehyde
  • Mollicellin F