Cas no 130688-21-0 (Piperidine,1-[2-[tetrahydro-2,2-dimethyl-4-(phenylmethyl)-2H-pyran-4-yl]ethyl]-)

Piperidine,1-[2-[tetrahydro-2,2-dimethyl-4-(phenylmethyl)-2H-pyran-4-yl]ethyl]- structure
130688-21-0 structure
Product Name:Piperidine,1-[2-[tetrahydro-2,2-dimethyl-4-(phenylmethyl)-2H-pyran-4-yl]ethyl]-
CAS No:130688-21-0
MF:C21H33NO
MW:315.492826223373
CID:143482
PubChem ID:3076287
Update Time:2025-04-19

Piperidine,1-[2-[tetrahydro-2,2-dimethyl-4-(phenylmethyl)-2H-pyran-4-yl]ethyl]- Chemical and Physical Properties

Names and Identifiers

    • Piperidine,1-[2-[tetrahydro-2,2-dimethyl-4-(phenylmethyl)-2H-pyran-4-yl]ethyl]-
    • 1-[2-(4-benzyl-2,2-dimethyloxan-4-yl)ethyl]piperidine
    • DTXSID00926852
    • Oprea1_515967
    • 1-(2-(Tetrahydro-2,2-dimethyl-4-(phenylmethyl)-2H-pyran-4-yl)ethyl)piperidine
    • Oprea1_527703
    • 130688-21-0
    • Piperidine, 1-(2-(tetrahydro-2,2-dimethyl-4-(phenylmethyl)-2H-pyran-4-yl)ethyl)-
    • BRN 4355255
    • Inchi: 1S/C21H33NO/c1-20(2)18-21(12-16-23-20,17-19-9-5-3-6-10-19)11-15-22-13-7-4-8-14-22/h3,5-6,9-10H,4,7-8,11-18H2,1-2H3
    • InChI Key: CFYZQFZUHMFACC-UHFFFAOYSA-N
    • SMILES: O1CCC(CC2C=CC=CC=2)(CCN2CCCCC2)CC1(C)C

Computed Properties

  • Exact Mass: 315.25639
  • Monoisotopic Mass: 315.256
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 23
  • Rotatable Bond Count: 5
  • Complexity: 355
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 4.5
  • Topological Polar Surface Area: 12.5?2

Experimental Properties

  • Density: 0.974
  • Boiling Point: 409.6°C at 760 mmHg
  • Flash Point: 120.3°C
  • Refractive Index: 1.511
  • PSA: 12.47
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