Cas no 3571-31-1 (1,8-dihydroxy-3-methoxy-6-methylanthracen-9(10H)-one)

1,8-dihydroxy-3-methoxy-6-methylanthracen-9(10H)-one structure
3571-31-1 structure
Product Name:1,8-dihydroxy-3-methoxy-6-methylanthracen-9(10H)-one
CAS No:3571-31-1
MF:C16H14O4
MW:270.279964923859
CID:920618
PubChem ID:19132
Update Time:2025-04-19

1,8-dihydroxy-3-methoxy-6-methylanthracen-9(10H)-one Chemical and Physical Properties

Names and Identifiers

    • 1,8-dihydroxy-3-methoxy-6-methylanthracen-9(10H)-one
    • 1,8-dihydroxy-3-methoxy-6-methyl-10H-anthracen-9-one
    • 1,8-Dihydroxy-3-methoxy-6-methyl-anthron
    • 1,8-dihydroxy-3-methoxy-6-methyl-anthrone
    • 1,8-Dihydroxy-3-methoxy-6-methylanthrone
    • 1,8-Dihydroxy-6-methoxy-3-methyl-9-anthron
    • 9(10H)-Anthracenone, 1,8-dihydroxy-3-methoxy-6-methyl-
    • ANTHRONE, 1,8-DIHYDROXY-3-METHOXY-6-METHYL-
    • BRN 1993152
    • CCRIS 6423
    • Physcion anthrone
    • Physcion-9-anthrone
    • Physcionanthron
    • Physcion-anthron B
    • Physcionanthrone B
    • NSC179488
    • 4-06-00-07808 (Beilstein Handbook Reference)
    • NSC 179488
    • 1,8-dihydroxy-6-methoxy-3-methyl-9-anthrone
    • NSC-179488
    • 72PNO71IWV
    • UNII-72PNO71IWV
    • 3571-31-1
    • 9(10H)-Anthracenone,8-dihydroxy-3-methoxy-6-methyl-
    • 1,8-DIHYDROXY-3-METHOXY-6-METHYL-9(10H)-ANTHRACENONE
    • DTXSID60189229
    • SCHEMBL16225766
    • Inchi： 1S/C16H14O4/c1-8-3-9-5-10-6-11(20-2)7-13(18)15(10)16(19)14(9)12(17)4-8/h3-4,6-7,17-18H,5H2,1-2H3
    • InChI Key： DRQZSQDHMHEDQS-UHFFFAOYSA-N
    • SMILES： O=C1C2C(=CC(=CC=2CC2C=C(C)C=C(C=21)O)OC)O

Computed Properties

  • Exact Mass: 270.08922
  • Monoisotopic Mass: 270.08920892g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 1
  • Complexity: 383
  • 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
  • Topological Polar Surface Area: 66.8?2
  • XLogP3: 3.5

Experimental Properties

  • Density: 1.353
  • Boiling Point: 546.6°C at 760 mmHg
  • Flash Point: 210.1°C
  • Refractive Index: 1.66
  • PSA: 66.76
  • LogP: 2.55000

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