Cas no 15862-01-8 (2-methoxy-4-nitro-1-phenylbenzene)

2-methoxy-4-nitro-1-phenylbenzene structure
15862-01-8 structure
Product Name:2-methoxy-4-nitro-1-phenylbenzene
CAS No:15862-01-8
MF:C13H11NO3
MW:229.231343507767
CID:1337398
PubChem ID:14774837
Update Time:2025-04-20

2-methoxy-4-nitro-1-phenylbenzene Chemical and Physical Properties

Names and Identifiers

    • 2-methoxy-4-nitro-1-phenylbenzene
    • AGN-PC-002IOY
    • 5-nitro 2-phenyl anisole
    • SureCN3185913
    • 2-methoxy-4-nitrobiphenyl
    • 4-nitro-2-methoxybiphenyle
    • 2-Methoxy-4-nitro-biphenyl
    • 1,1'-Biphenyl, 2-methoxy-4-nitro-
    • 5-Nitro-2-phenylanisole
    • DB-293232
    • AMY7283
    • ZWZJLJMULXIMLU-UHFFFAOYSA-N
    • 2-Methoxy-4-nitro-1,1'-biphenyl
    • SCHEMBL3185913
    • AKOS002320030
    • 15862-01-8
    • DTXSID80563901
    • Inchi: 1S/C13H11NO3/c1-17-13-9-11(14(15)16)7-8-12(13)10-5-3-2-4-6-10/h2-9H,1H3
    • InChI Key: ZWZJLJMULXIMLU-UHFFFAOYSA-N
    • SMILES: O(C)C1C=C(C=CC=1C1C=CC=CC=1)[N+](=O)[O-]

Computed Properties

  • Exact Mass: 229.07393
  • Monoisotopic Mass: 229.07389321g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 2
  • Complexity: 258
  • 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: 3.3
  • Topological Polar Surface Area: 55?2

Experimental Properties

  • Density: 1.202±0.06 g/cm3 (20 oC 760 Torr),
  • Melting Point: 60-61 oC
  • Solubility: Almost insoluble (0.032 g/l) (25 o C),
  • PSA: 52.37
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