Cas no 5461-92-7 (2-methyl-5-(propan-2-yl)cyclohexanamine)

2-methyl-5-(propan-2-yl)cyclohexanamine structure
5461-92-7 structure
Product Name:2-methyl-5-(propan-2-yl)cyclohexanamine
CAS No:5461-92-7
MF:C10H22ClN
MW:191.74138212204
CID:942215
PubChem ID:54603691
Update Time:2025-04-19

2-methyl-5-(propan-2-yl)cyclohexanamine Chemical and Physical Properties

Names and Identifiers

    • 2-methyl-5-(propan-2-yl)cyclohexanamine
    • 2-methyl-5-propan-2-ylcyclohexan-1-amine,hydrochloride
    • NSC25098
    • NSC-25098
    • DTXSID50713719
    • 2-Methyl-5-(propan-2-yl)cyclohexan-1-amine--hydrogen chloride (1/1)
    • NSC 25098
    • 5461-92-7
    • Inchi: 1S/C10H21N.ClH/c1-7(2)9-5-4-8(3)10(11)6-9;/h7-10H,4-6,11H2,1-3H3;1H
    • InChI Key: ZGWRVTAGKQPDFC-UHFFFAOYSA-N
    • SMILES: Cl.NC1CC(C(C)C)CCC1C

Computed Properties

  • Exact Mass: 191.14400
  • Monoisotopic Mass: 191.144
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 1
  • Complexity: 120
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 3
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 26A^2

Experimental Properties

  • Density: 0.834
  • Boiling Point: 195.9°C at 760 mmHg
  • Flash Point: 49.1°C
  • Refractive Index: 1.447
  • PSA: 26.02000
  • LogP: 3.90820
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