Cas no 175696-74-9 (3-Piperidin-1-ylbenzonitrile)

3-Piperidin-1-ylbenzonitrile structure
3-Piperidin-1-ylbenzonitrile structure
Product Name:3-Piperidin-1-ylbenzonitrile
CAS No:175696-74-9
MF:C12H14N2
MW:186.252962589264
CID:66035
PubChem ID:7060566
Update Time:2025-04-18

3-Piperidin-1-ylbenzonitrile Chemical and Physical Properties

Names and Identifiers

    • 3-(Piperidin-1-yl)benzonitrile
    • 3-PIPERIDIN-1-YLBENZONITRILE
    • 3-piperidinobenzonitrile
    • 3-piperidylbenzenecarbonitrile
    • 3-(1-piperidinyl)benzonitrile
    • 3-Piperidine-1-ylbenzonitrile
    • A812105
    • IMEMJQTXKKOYGR-UHFFFAOYSA-N
    • Benzonitrile, 3-(1-piperidinyl)-
    • SCHEMBL4468086
    • W-206230
    • DTXSID60427633
    • AKOS006345245
    • SB41286
    • MFCD07368527
    • CS-0207016
    • (3R,4R)-3,4-Difluoro-1-pyrrolidinecarboxylicacidphenylmethylesterhydrochloride
    • 175696-74-9
    • 3-piperidin-1-yl-benzonitrile
    • F14690
    • TS-02614
    • FT-0692259
    • 3-Piperidin-1-ylbenzonitrile97%
    • DB-065116
    • 3-Piperidin-1-ylbenzonitrile
    • MDL: MFCD07368527
    • Inchi: 1S/C12H14N2/c13-10-11-5-4-6-12(9-11)14-7-2-1-3-8-14/h4-6,9H,1-3,7-8H2
    • InChI Key: IMEMJQTXKKOYGR-UHFFFAOYSA-N
    • SMILES: N1(C2C=CC=C(C#N)C=2)CCCCC1

Computed Properties

  • Exact Mass: 186.11600
  • Monoisotopic Mass: 186.115698455g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 1
  • Complexity: 222
  • 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: 2.7
  • Topological Polar Surface Area: 27?2

Experimental Properties

  • Melting Point: 133 °C
  • PSA: 27.03000
  • LogP: 2.61358

3-Piperidin-1-ylbenzonitrile Security Information

  • Hazard Statement: Irritant
  • Hazardous Material Identification: Xi

3-Piperidin-1-ylbenzonitrile Pricemore >>

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3-Piperidin-1-ylbenzonitrile Production Method

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