Cas no 131086-91-4 (3,7-dimethoxy-6H-benzo[c]chromen-6-one)

3,7-dimethoxy-6H-benzo[c]chromen-6-one structure
131086-91-4 structure
Product Name:3,7-dimethoxy-6H-benzo[c]chromen-6-one
CAS No:131086-91-4
MF:C15H12O4
MW:256.253384590149
CID:1227468
PubChem ID:148354
Update Time:2025-04-20

3,7-dimethoxy-6H-benzo[c]chromen-6-one Chemical and Physical Properties

Names and Identifiers

    • 3,7-dimethoxy-6H-benzo[c]chromen-6-one
    • 6H-Dibenzo(b,d)pyran-6-one, 3,7-dimethoxy-
    • 3,7-dimethoxybenzo[c]chromen-6-one
    • 131086-91-4
    • DTXSID70156881
    • SCHEMBL9747805
    • Inchi: 1S/C15H12O4/c1-17-9-6-7-10-11-4-3-5-12(18-2)14(11)15(16)19-13(10)8-9/h3-8H,1-2H3
    • InChI Key: ZTYNMJCCMBHGQY-UHFFFAOYSA-N
    • SMILES: O1C(C2C(=CC=CC=2C2C=CC(=CC1=2)OC)OC)=O

Computed Properties

  • Exact Mass: 256.07356
  • Monoisotopic Mass: 256.07355886g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 2
  • Complexity: 343
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 3
  • Topological Polar Surface Area: 44.8?2

Experimental Properties

  • PSA: 44.76
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