Cas no 887595-75-7 (Benzenemethanamine,3-(hexahydro-1H-azepin-1-yl)-)

Benzenemethanamine,3-(hexahydro-1H-azepin-1-yl)- structure
887595-75-7 structure
Product Name:Benzenemethanamine,3-(hexahydro-1H-azepin-1-yl)-
CAS No:887595-75-7
MF:C13H20N2
MW:204.311303138733
CID:713857
Update Time:2024-01-31

Benzenemethanamine,3-(hexahydro-1H-azepin-1-yl)- Chemical and Physical Properties

Names and Identifiers

    • Benzenemethanamine,3-(hexahydro-1H-azepin-1-yl)-
    • [3-(azepan-1-yl)phenyl]methanamine
    • 3-AZEPAN-1-YL-BENZYLAMINE
    • MDL: MFCD07785879
    • Inchi: 1S/C13H20N2/c14-11-12-6-5-7-13(10-12)15-8-3-1-2-4-9-15/h5-7,10H,1-4,8-9,11,14H2
    • InChI Key: DDLZIAOISXHHCP-UHFFFAOYSA-N
    • SMILES: NCC1=CC=CC(N2CCCCCC2)=C1

Computed Properties

  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 2
  • Complexity: 173
  • 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
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: 2.1

Benzenemethanamine,3-(hexahydro-1H-azepin-1-yl)- Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
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