Cas no 67306-04-1 (1-[3-(4-tert-butylphenyl)-2-methylpropyl]-3,5-dimethylpiperidine)

1-[3-(4-tert-butylphenyl)-2-methylpropyl]-3,5-dimethylpiperidine structure
67306-04-1 structure
Product Name:1-[3-(4-tert-butylphenyl)-2-methylpropyl]-3,5-dimethylpiperidine
CAS No:67306-04-1
MF:C21H35N
MW:301.509306192398
CID:1722500
PubChem ID:3051197
Update Time:2025-04-21

1-[3-(4-tert-butylphenyl)-2-methylpropyl]-3,5-dimethylpiperidine Chemical and Physical Properties

Names and Identifiers

    • 1-[3-(4-tert-butylphenyl)-2-methylpropyl]-3,5-dimethylpiperidine
    • DTXSID70986569
    • N-(3'-(p-tert-Butylphenyl)-2'-methylpropyl-1')-3,5-dimethylpiperidin
    • N-(3'-(p-tert-Butylphenyl)-2'-methylpropyl-1')-3,5-dimethylpiperidin [German]
    • 67306-04-1
    • 1-[3-(p-tert.butyl-phenyl)-2-methyl-propyl]-3,5-dimethyl-piperidine
    • Piperidine, 3,5-dimethyl-1-(3-(4-(1,1-dimethylethyl)phenyl)-2-methylpropyl)-
    • PNPAYADWLSERQE-UHFFFAOYSA-N
    • SCHEMBL9296973
    • 3,5-Dimethyl-1-(3-(4-(1,1-dimethylethyl)phenyl)-2-methylpropyl)piperidine
    • Inchi： 1S/C21H35N/c1-16-11-17(2)14-22(13-16)15-18(3)12-19-7-9-20(10-8-19)21(4,5)6/h7-10,16-18H,11-15H2,1-6H3
    • InChI Key： PNPAYADWLSERQE-UHFFFAOYSA-N
    • SMILES： N1(CC(C)CC2C=CC(=CC=2)C(C)(C)C)CC(C)CC(C)C1

Computed Properties

  • Exact Mass: 301.27715
  • Monoisotopic Mass: 301.27695
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 22
  • Rotatable Bond Count: 5
  • Complexity: 311
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 3
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 3.2
  • XLogP3: 6.4

Experimental Properties

  • Density: 0.897
  • Boiling Point: 388.1°C at 760 mmHg
  • Flash Point: 169°C
  • Refractive Index: 1.492
  • PSA: 3.24

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