Coumarin 314

CAS Registry Number®

55804-66-5

CAS Name

Coumarin 314

Molecular Formula

C18H19NO4

Molecular Mass

313.35

Cite this Page

Coumarin 314.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=55804-66-5 (retrieved 2024-11-22) (CAS RN: 55804-66-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    139-141 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C18H19NO4/c1-2-22-17(20)14-10-12-9-11-5-3-7-19-8-4-6-13(15(11)19)16(12)23-18(14)21/h9-10H,2-8H2,1H3

InChIKey

InChIKey=VMJKUPWQKZFFCX-UHFFFAOYSA-N

SMILES

O=C1OC2=C3C4=C(C=C2C=C1C(OCC)=O)CCCN4CCC3

Canonical SMILES

O=C1OC2=C(C=C1C(=O)OCC)C=C3C4=C2CCCN4CCC3

Other Names for this Substance

  • 1H,5H,11H-[1]Benzopyrano[6,7,8-ij]quinolizine-10-carboxylic acid, 2,3,6,7-tetrahydro-11-oxo-, ethyl ester
  • Coumarin 314
  • Coumarin 504
  • C 314
  • NSC 338967

Deleted or Replaced CAS Registry Numbers

75496-02-5

CAS INSIGHTSTM
Targeted protein degrader structure, illustration