Cas no 59397-23-8 (Cycloheptanamine, 1-phenyl-)

Cycloheptanamine, 1-phenyl- structure
Cycloheptanamine, 1-phenyl- structure
Product Name:Cycloheptanamine, 1-phenyl-
CAS No:59397-23-8
MF:C13H19N
MW:189.29666352272
CID:386918
PubChem ID:322435
Update Time:2025-04-19

Cycloheptanamine, 1-phenyl- Chemical and Physical Properties

Names and Identifiers

    • Cycloheptanamine, 1-phenyl-
    • 1-phenylcycloheptan-1-amine
    • 1-phenylcycloheptanamine
    • 1-phenylcycloheptylamine
    • AC1L86FW
    • CHEMBL253135
    • CTK1H5044
    • NSC279902
    • SureCN7741012
    • DTXSID60314019
    • TQP1678
    • NSC-279902
    • SCHEMBL7741012
    • 59397-23-8
    • Inchi: 1S/C13H19N/c14-13(10-6-1-2-7-11-13)12-8-4-3-5-9-12/h3-5,8-9H,1-2,6-7,10-11,14H2
    • InChI Key: LTWBQSVETWWOFJ-UHFFFAOYSA-N
    • SMILES: NC1(C2C=CC=CC=2)CCCCCC1

Computed Properties

  • Exact Mass: 189.15187
  • Monoisotopic Mass: 189.152
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 1
  • Complexity: 162
  • 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: 2.9
  • Topological Polar Surface Area: 26?2

Experimental Properties

  • Density: 0.973
  • Boiling Point: 292.2°Cat760mmHg
  • Flash Point: 132.9°C
  • Refractive Index: 1.531
  • PSA: 26.02
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