Cas no 161308-34-5 (1-Butanesulfonic acid,4-(cyclohexylamino)-)

1-Butanesulfonic acid,4-(cyclohexylamino)- structure
161308-34-5 structure
Product Name:1-Butanesulfonic acid,4-(cyclohexylamino)-
CAS No:161308-34-5
MF:C10H21NO3S
MW:235.343641996384
CID:109734
PubChem ID:329775095
Update Time:2025-04-18

1-Butanesulfonic acid,4-(cyclohexylamino)- Chemical and Physical Properties

Names and Identifiers

    • 1-Butanesulfonic acid,4-(cyclohexylamino)-
    • CABS
    • 4-(cyclohexylamino)butane-1-sulfonic acid
    • CABS, 0.2M BUFFER SOLN., PH 10.5
    • 4-[cyclohexylaMino]-1-butanesulfonic acid
    • 1-Butanesulfonicacid,4-(cyclohexylamino)-
    • MFCD00676598
    • CABS, >=98%
    • 1-Butanesulfonic acid, 4-(cyclohexylamino)-
    • 161308-34-5
    • 4-(cyclohexylamino)-1-butanesulfonic acid
    • J-009809
    • XNPKNHHFCKSMRV-UHFFFAOYSA-N
    • SCHEMBL165817
    • DTXSID00458764
    • CS-0514662
    • G78268
    • HY-W414406
    • MDL: MFCD00676598
    • Inchi: 1S/C10H21NO3S/c12-15(13,14)9-5-4-8-11-10-6-2-1-3-7-10/h10-11H,1-9H2,(H,12,13,14)
    • InChI Key: XNPKNHHFCKSMRV-UHFFFAOYSA-N
    • SMILES: S(CCCCNC1CCCCC1)(=O)(=O)O

Computed Properties

  • Exact Mass: 235.12421471g/mol
  • Monoisotopic Mass: 235.12421471g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 6
  • Complexity: 252
  • 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: -1.1
  • Topological Polar Surface Area: 74.8?2

Experimental Properties

  • Density: 1.17±0.1 g/cm3 (20 oC 760 Torr),
  • Solubility: Slightly soluble (18 g/l) (25 o C),
  • pka: 10.7(at 25℃)

1-Butanesulfonic acid,4-(cyclohexylamino)- Security Information

  • Symbol: GHS07
  • Signal Word:Warning
  • Hazard Statement: H315,H319,H335
  • Warning Statement: P261,P305+P351+P338
  • Hazardous Material transportation number:NONH for all modes of transport
  • WGK Germany:3
  • Hazard Category Code: 36/37/38
  • Safety Instruction: 26
  • Hazardous Material Identification: Xi

1-Butanesulfonic acid,4-(cyclohexylamino)- Pricemore >>

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