7-(Acetyloxy)-6-(2,3-dibromopropyl)-4,8-dimethyl-2H-1-benzopyran-2-one

CAS Registry Number®

3993-46-2
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CAS Name

7-(Acetyloxy)-6-(2,3-dibromopropyl)-4,8-dimethyl-2H-1-benzopyran-2-one

Molecular Formula

C16H16Br2O4

Molecular Mass

432.10

Cite this Page

7-(Acetyloxy)-6-(2,3-dibromopropyl)-4,8-dimethyl-2H-1-benzopyran-2-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=3993-46-2 (retrieved 2024-04-27) (CAS RN: 3993-46-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    141.5-142.5 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C16H16Br2O4/c1-8-4-14(20)22-16-9(2)15(21-10(3)19)11(6-13(8)16)5-12(18)7-17/h4,6,12H,5,7H2,1-3H3

InChIKey

InChIKey=FCDMHZRMXOOYRQ-UHFFFAOYSA-N

SMILES

CC=1C=2C(=C(C)C(OC(C)=O)=C(CC(CBr)Br)C2)OC(=O)C1

Canonical SMILES

O=C1OC2=C(C=C(C(OC(=O)C)=C2C)CC(Br)CBr)C(=C1)C

Other Names for this Substance

  • 2H-1-Benzopyran-2-one, 7-(acetyloxy)-6-(2,3-dibromopropyl)-4,8-dimethyl-
  • Coumarin, 6-(2,3-dibromopropyl)-7-hydroxy-4,8-dimethyl-, acetate
  • Umbelliferone, 6-(2,3-dibromopropyl)-4,8-dimethyl-, acetate
  • 7-(Acetyloxy)-6-(2,3-dibromopropyl)-4,8-dimethyl-2H-1-benzopyran-2-one

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