Cas no 884535-16-4 (4-(hydroxymethyl)-4-azepanol hydrochloride)

4-(hydroxymethyl)-4-azepanol hydrochloride structure
884535-16-4 structure
Product Name:4-(hydroxymethyl)-4-azepanol hydrochloride
CAS No:884535-16-4
MF:C7H16ClNO2
MW:181.660441398621
MDL:MFCD26959433
CID:3215313
PubChem ID:67198386
Update Time:2025-04-21

4-(hydroxymethyl)-4-azepanol hydrochloride Chemical and Physical Properties

Names and Identifiers

    • 1H-AZEPINE-4-METHANOL, HEXAHYDRO-4-HYDROXY-, HYDROCHLORIDE
    • 4-(hydroxymethyl)-4-azepanol hydrochloride
    • 1H-Azepine-4-methanol, hexahydro-4-hydroxy-, hydrochloride (1:1)
    • BS-40235
    • 4-(hydroxymethyl)azepan-4-ol hydrochloride
    • JXKCNQFCMQPUBN-UHFFFAOYSA-N
    • 4-(Hydroxymethyl)-4-azepanol HCl
    • 4-(HYDROXYMETHYL)AZEPAN-4-OL HCL
    • 884535-16-4
    • 4-(hydroxymethyl)azepan-4-olhydrochloride
    • 4-(hydroxymethyl)azepan-4-ol;hydrochloride
    • 4-(hydroxymethyl)azepane-4-ol hydrochloride
    • AKOS027426951
    • SCHEMBL1880406
    • MFCD26959433
    • AT29830
    • MDL: MFCD26959433
    • Inchi: 1S/C7H15NO2.ClH/c9-6-7(10)2-1-4-8-5-3-7;/h8-10H,1-6H2;1H
    • InChI Key: JXKCNQFCMQPUBN-UHFFFAOYSA-N
    • SMILES: C(C1(CCNCCC1)O)O.Cl

Computed Properties

  • Exact Mass: 181.087
  • Monoisotopic Mass: 181.087
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 4
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 1
  • Complexity: 108
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 52.5A^2

Experimental Properties

  • LogP: 0.61410

4-(hydroxymethyl)-4-azepanol hydrochloride Pricemore >>

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