Cas no 46053-72-9 (5-Nitroisoindoline)

5-Nitroisoindoline structure
5-Nitroisoindoline structure
Product Name:5-Nitroisoindoline
CAS No:46053-72-9
MF:C8H8N2O2
MW:164.161321640015
MDL:MFCD08234855
CID:828930
PubChem ID:6424469
Update Time:2025-04-19

5-Nitroisoindoline Chemical and Physical Properties

Names and Identifiers

    • 5-Nitroisoindoline
    • 5-nitro-2,3-dihydro-1H-isoindole
    • 1H-Isoindole,2,3-dihydro-5-nitro
    • 5-nitro-isoindoline
    • AKOS006238354
    • F13853
    • 1H-Isoindole, 2,3-dihydro-5-nitro-
    • DB-070708
    • 46053-72-9
    • SCHEMBL383577
    • WBA05372
    • AB43659
    • DTXSID30423703
    • MFCD08234855
    • EN300-91271
    • J-517880
    • MDL: MFCD08234855
    • Inchi: 1S/C8H8N2O2/c11-10(12)8-2-1-6-4-9-5-7(6)3-8/h1-3,9H,4-5H2
    • InChI Key: UYSFPRNOPWMPJW-UHFFFAOYSA-N
    • SMILES: [O-][N+](C1C=CC2CNCC=2C=1)=O

Computed Properties

  • Exact Mass: 164.05900
  • Monoisotopic Mass: 164.058577502g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 1
  • Complexity: 190
  • 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: 0.7
  • Topological Polar Surface Area: 57.8?2

Experimental Properties

  • Density: 1.298
  • Boiling Point: 293 oC
  • Flash Point: 131 oC
  • PSA: 57.85000
  • LogP: 2.05000

5-Nitroisoindoline Customs Data

  • HS CODE:2933990090
  • Customs Data:

    China Customs Code:

    2933990090

    Overview:

    2933990090. Other heterocyclic compounds containing only nitrogen heteroatoms. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to, Please indicate the appearance of Urotropine, 6- caprolactam please indicate the appearance, Signing date

    Summary:

    2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

5-Nitroisoindoline Pricemore >>

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