Cas no 85099-36-1 (gamma,4-Dimethylcyclohexene-1-propan-1-amine)

gamma,4-Dimethylcyclohexene-1-propan-1-amine structure
85099-36-1 structure
Product Name:gamma,4-Dimethylcyclohexene-1-propan-1-amine
CAS No:85099-36-1
MF:C11H21N
MW:167.29114317894
CID:730122
Update Time:2023-08-03

gamma,4-Dimethylcyclohexene-1-propan-1-amine Chemical and Physical Properties

Names and Identifiers

    • 3-Cyclohexene-1-propanamine,g,4-dimethyl-
    • gamma,4-Dimethylcyclohexene-1-propan-1-amine
    • SXJIEXCRGRWIOO-UHFFFAOYSA-N
    • 3-(1methylcyclohexen-4-yl)-butylamine
    • 3-(1-methylcyclohexen-4-yl)-butylamine
    • gamma,4-Dimethyl-3-cyclohexene-1-propan-1-amine
    • Inchi: 1S/C11H21N/c1-9-3-5-11(6-4-9)10(2)7-8-12/h3,10-11H,4-8,12H2,1-2H3
    • InChI Key: SXJIEXCRGRWIOO-UHFFFAOYSA-N
    • SMILES: NCCC(C)C1CC=C(C)CC1

Computed Properties

  • Exact Mass: 167.1674
  • Monoisotopic Mass: 167.1674
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 3
  • Complexity: 160
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 2
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 26

Experimental Properties

  • Density: 0.88
  • Boiling Point: 237.8°C at 760 mmHg
  • Flash Point: 96.1°C
  • Refractive Index: 1.48
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