Cas no 23938-42-3 (3-(1-ADAMANTYL)-3-OXOPROPANENITRILE)

3-(1-ADAMANTYL)-3-OXOPROPANENITRILE structure
23938-42-3 structure
Product Name:3-(1-ADAMANTYL)-3-OXOPROPANENITRILE
CAS No:23938-42-3
MF:C13H17NO
MW:203.280183553696
MDL:MFCD07789716
CID:891221
PubChem ID:584949
Update Time:2025-04-19

3-(1-ADAMANTYL)-3-OXOPROPANENITRILE Chemical and Physical Properties

Names and Identifiers

    • 3-(1-ADAMANTYL)-3-OXOPROPANENITRILE
    • 3-ADAMANTAN-1-YL-3-OXO-PROPIONITRILE
    • 3-adamantanyl-3-oxopropanenitrile
    • SCHEMBL1072567
    • BRD-K38304471-001-01-5
    • 23938-42-3
    • ALVFKYUPAPUUIU-UHFFFAOYSA-N
    • SY082872
    • 3-oxo-3-(tricyclo[3.3.1.1~3,7~]dec-1-yl)propanenitrile
    • STK501267
    • CS-0315023
    • 3-(adamantan-1-yl)-3-oxopropanenitrile
    • LS-02773
    • ALBB-007395
    • 3-(1-Adamantyl)-3-oxopropanenitrile #
    • DTXSID40342835
    • AKOS000168939
    • MFCD07789716
    • MDL: MFCD07789716
    • Inchi: 1S/C13H17NO/c14-2-1-12(15)13-6-9-3-10(7-13)5-11(4-9)8-13/h9-11H,1,3-8H2
    • InChI Key: ALVFKYUPAPUUIU-UHFFFAOYSA-N
    • SMILES: O=C(CC#N)C12CC3CC(CC(C3)C1)C2

Computed Properties

  • Exact Mass: 203.13100
  • Monoisotopic Mass: 203.131
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 2
  • Complexity: 308
  • 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: 2.4
  • Topological Polar Surface Area: 40.9?2

Experimental Properties

  • PSA: 40.86000
  • LogP: 2.68558

3-(1-ADAMANTYL)-3-OXOPROPANENITRILE Security Information

  • Hazard Category Code: 25
  • Safety Instruction: 45
  • Hazardous Material Identification: T
  • HazardClass:IRRITANT

3-(1-ADAMANTYL)-3-OXOPROPANENITRILE Customs Data

  • HS CODE:2926909090
  • Customs Data:

    China Customs Code:

    2926909090

    Overview:

    2926909090 Other nitrile based compounds. VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:6.5% general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

3-(1-ADAMANTYL)-3-OXOPROPANENITRILE Pricemore >>

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