4-(Cyclohexylamino)-1-butanesulfonic acid

Base Information

• Chemical Name: 4-(Cyclohexylamino)-1-butanesulfonic acid
• CAS No.: 161308-34-5
• Molecular Formula: C10H21NO3S
• Molecular Weight: 235.34
• European Community (EC) Number: 629-080-0
• DSSTox Substance ID: DTXSID00458764
• Mol file: 161308-34-5.mol

Synonyms:161308-34-5;CABS;4-(cyclohexylamino)-1-butanesulfonic acid;4-(cyclohexylamino)butane-1-sulfonic Acid;1-Butanesulfonic acid, 4-(cyclohexylamino)-;4-[CYCLOHEXYLAMINO]-1-BUTANESULFONIC ACID;SCHEMBL165817;DTXSID00458764;XNPKNHHFCKSMRV-UHFFFAOYSA-N;CABS, >=98%;1-Butanesulfonicacid,4-(cyclohexylamino)-;J-009809

Chemical Property of 4-(Cyclohexylamino)-1-butanesulfonic acid

Chemical Property:

• Vapor Pressure: 0-0Pa at 20-25℃
• PKA: 10.7(at 25℃)
• PSA: 74.78000
• Density: 1.171 g/cm³
• LogP: 3.04840
• XLogP3: -1.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 235.12421471
• Heavy Atom Count: 15
• Complexity: 252

Purity/Quality:

99%, ^*data from raw suppliers

CABS ≥98% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C1CCC(CC1)NCCCCS(=O)(=O)O