2-[[(1,2-Benzisothiazol-3-yloxy)methyl]cyclohexylamino]ethanol

Base Information

• Chemical Name: 2-[[(1,2-Benzisothiazol-3-yloxy)methyl]cyclohexylamino]ethanol
• CAS No.: 94087-26-0
• Molecular Formula: C16H22 N2 O2 S
• Molecular Weight: 306.42308
• European Community (EC) Number: 301-919-2
• DSSTox Substance ID: DTXSID10240415
• Nikkaji Number: J368.038J
• Wikidata: Q83123264
• Mol file: 94087-26-0.mol

Synonyms:94087-26-0;EINECS 301-919-2;2-[[(1,2-BENZISOTHIAZOL-3-YLOXY)METHYL]CYCLOHEXYLAMINO]ETHANOL;2-(((1,2-Benzisothiazol-3-yloxy)methyl)cyclohexylamino)ethanol;DTXSID10240415

Chemical Property of 2-[[(1,2-Benzisothiazol-3-yloxy)methyl]cyclohexylamino]ethanol

Chemical Property:

• Vapor Pressure: 3.8E-08mmHg at 25°C
• Boiling Point: 429.7°Cat760mmHg
• Flash Point: 213.7°C
• PSA: 73.83000
• Density: 1.24g/cm³
• LogP: 3.25960
• XLogP3: 3.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 6
• Exact Mass: 306.14019912
• Heavy Atom Count: 21
• Complexity: 313

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCC(CC1)N(CCO)COC2=NSC3=CC=CC=C32