Cas no 883500-80-9 (5-fluoro-1H-indole-7-carbonitrile)

5-fluoro-1H-indole-7-carbonitrile structure
883500-80-9 structure
Product Name:5-fluoro-1H-indole-7-carbonitrile
CAS No:883500-80-9
MF:C9H5FN2
MW:160.14780497551
MDL:MFCD04037879
CID:890826
PubChem ID:3696253
Update Time:2025-04-19

5-fluoro-1H-indole-7-carbonitrile Chemical and Physical Properties

Names and Identifiers

    • 7-CYANO-5-FLUOROINDOLE
    • 5-fluoro-1H-indole-7-carbonitrile
    • 5-Fluoro-indole-7-carbonitrile
    • 7-Cyano-5-fluoro-1H-indole
    • PC6099
    • AKOS006292642
    • JZPYATWYHRJOAJ-UHFFFAOYSA-N
    • 883500-80-9
    • SCHEMBL1420429
    • SB15234
    • BB 0259911
    • FT-0677006
    • DTXSID90395174
    • G82789
    • MDL: MFCD04037879
    • Inchi: 1S/C9H5FN2/c10-8-3-6-1-2-12-9(6)7(4-8)5-11/h1-4,12H
    • InChI Key: JZPYATWYHRJOAJ-UHFFFAOYSA-N
    • SMILES: FC1C=C(C#N)C2=C(C=1)C=CN2

Computed Properties

  • Exact Mass: 160.04400
  • Monoisotopic Mass: 160.04367633g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 0
  • Complexity: 220
  • 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: 1.9
  • Topological Polar Surface Area: 39.6?2

Experimental Properties

  • PSA: 39.58000
  • LogP: 2.17868

5-fluoro-1H-indole-7-carbonitrile Security Information

  • Hazardous Material Identification: Xi
  • HazardClass:IRRITANT

5-fluoro-1H-indole-7-carbonitrile 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-fluoro-1H-indole-7-carbonitrile Pricemore >>

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