Cas no 15918-62-4 (Phenanthro[4,3-d]-1,3-dioxole-5-carboxylicacid, 8,10-dimethoxy-6-nitro-)

Phenanthro[4,3-d]-1,3-dioxole-5-carboxylicacid, 8,10-dimethoxy-6-nitro- structure
15918-62-4 structure
Product Name:Phenanthro[4,3-d]-1,3-dioxole-5-carboxylicacid, 8,10-dimethoxy-6-nitro-
CAS No:15918-62-4
MF:C18H13NO8
MW:371.297725439072
CID:140353
PubChem ID:167493
Update Time:2025-04-19

Phenanthro[4,3-d]-1,3-dioxole-5-carboxylicacid, 8,10-dimethoxy-6-nitro- Chemical and Physical Properties

Names and Identifiers

    • Phenanthro[4,3-d]-1,3-dioxole-5-carboxylicacid, 8,10-dimethoxy-6-nitro-
    • ARISTOLOCHICACIDSALTS
    • 2,3-Methylenedioxy-5,7-dimethoxy-10-nitrophenanthroic acid
    • 6-Methoxyaristolochic acid D
    • 8,10-Dimethoxy-6-nitrophenanthro(3,4-d)-1,3-dioxole-5-carboxylic acid
    • Aristolochic acid IV
    • Aristolochic acid IV(sub a) methyl ether
    • BRN 1332635
    • O-Methylaristolochic acid D
    • Phenanthro(3,4-d)-1,3-dioxole-5-carboxylic acid, 8,10-dimethoxy-6-nitro-
    • NS00094664
    • BDBM50306857
    • Phenanthro[3,4-d]-1,3-dioxole-5-carboxylic acid, 8,10-dimethoxy-6-nitro-
    • CHEMBL465004
    • 15918-62-4
    • 8,10-dimethoxy-6-nitrophenanthro[3,4-d][1,3]dioxole-5-carboxylic acid
    • 6-Nitro-8,10-dimethoxy-phenanthro[3,4-d]-1,3-dioxol-5-carbonsaure
    • 8,10-dimethoxy-6-nitronaphtho[2,1-g][1,3]benzodioxole-5-carboxylic acid
    • DTXSID30166603
    • L28X6WY776
    • 8,10-Dimethoxy-6-nitrophenanthro[3,4-d]-1,3-dioxole-5-carboxylic acid
    • Inchi： 1S/C18H13NO8/c1-24-8-3-10-9(13(4-8)25-2)5-12(19(22)23)15-11(18(20)21)6-14-17(16(10)15)27-7-26-14/h3-6H,7H2,1-2H3,(H,20,21)
    • InChI Key： GYBINMVKWZEICQ-UHFFFAOYSA-N
    • SMILES： O1COC2=CC(C(=O)O)=C3C(=CC4C(=CC(=CC=4C3=C12)OC)OC)[N+](=O)[O-]

Computed Properties

  • Exact Mass: 371.06409
  • Monoisotopic Mass: 371.06411637g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 8
  • Heavy Atom Count: 27
  • Rotatable Bond Count: 3
  • Complexity: 594
  • 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: 3.5
  • Topological Polar Surface Area: 120?2

Experimental Properties

  • Density: 1.5343 (rough estimate)
  • Boiling Point: 501°C (rough estimate)
  • Refractive Index: 1.5100 (estimate)
  • PSA: 117.36

Phenanthro[4,3-d]-1,3-dioxole-5-carboxylicacid, 8,10-dimethoxy-6-nitro- Related Literature

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