Cas no 101327-87-1 (8-Nitro-7-quinolinecarboxaldehyde)

8-Nitro-7-quinolinecarboxaldehyde structure
101327-87-1 structure
Product Name:8-Nitro-7-quinolinecarboxaldehyde
CAS No:101327-87-1
MF:C10H6N2O3
MW:202.16624212265
MDL:MFCD08436438
CID:1128715
PubChem ID:87561231
Update Time:2025-04-20

8-Nitro-7-quinolinecarboxaldehyde Chemical and Physical Properties

Names and Identifiers

    • 8-Nitro-7-quinolinecarboxaldehyde
    • 8-amino-7-quinolinecarbaldehyde
    • 7-Quinolinecarboxaldehyde, 8-nitro-
    • AGN-PC-00FSON
    • ANW-14454
    • CTK3J9690
    • 8-nitro-7-quinolinecarbaldehyde
    • ACMC-2097uw
    • 7-Formyl-8-nitroquinoline
    • 8-nitro-quinoline-7-carbaldehyde
    • 8-nitroquinoline-7-carbaldehyde
    • 8-Nitroquinoline-7-carboxaldehyde
    • CGYVBVWBGRTQJQ-UHFFFAOYSA-N
    • BB 0262709
    • N0852
    • SY106138
    • CS-0131621
    • 101327-87-1
    • SCHEMBL1011709
    • AS-62211
    • DB-369719
    • AKOS000319912
    • DTXSID70472154
    • MFCD08436438
    • F16251
    • SB71926
    • MDL: MFCD08436438
    • Inchi: 1S/C10H6N2O3/c13-6-8-4-3-7-2-1-5-11-9(7)10(8)12(14)15/h1-6H
    • InChI Key: CGYVBVWBGRTQJQ-UHFFFAOYSA-N
    • SMILES: [O-][N+](C1=C(C=O)C=CC2=CC=CN=C21)=O

Computed Properties

  • Exact Mass: 202.03800
  • Monoisotopic Mass: 202.03784206g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 1
  • Complexity: 264
  • 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: 75.8
  • XLogP3: 1.5

Experimental Properties

  • Density: 1.441±0.06 g/cm3 (20 oC 760 Torr),
  • Melting Point: 178.0 to 182.0 deg-C
  • Solubility: Very slightly soluble (0.11 g/l) (25 o C),
  • PSA: 75.78000
  • LogP: 2.47870

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