3-(1,2-Benzisothiazol-3-yloxy)-N,N,2-trimethylpropylamine

Base Information

• Chemical Name: 3-(1,2-Benzisothiazol-3-yloxy)-N,N,2-trimethylpropylamine
• CAS No.: 94087-29-3
• Molecular Formula: C13H18 N2 O S
• Molecular Weight: 250.35982
• European Community (EC) Number: 301-922-9
• DSSTox Substance ID: DTXSID20916558
• Nikkaji Number: J368.041J
• Mol file: 94087-29-3.mol

Synonyms:94087-29-3;3-(1,2-Benzisothiazol-3-yloxy)-N,N,2-trimethylpropylamine;EINECS 301-922-9;DTXSID20916558;3-(1,2-Benzisothiazol-3-yloxy)-N,N,2-trimethyl-1-propanamine;3-[(1,2-Benzothiazol-3-yl)oxy]-N,N,2-trimethylpropan-1-amine

Chemical Property of 3-(1,2-Benzisothiazol-3-yloxy)-N,N,2-trimethylpropylamine

Chemical Property:

• Vapor Pressure: 0.000779mmHg at 25°C
• Boiling Point: 306.3°Cat760mmHg
• Flash Point: 139°C
• PSA: 53.60000
• Density: 1.135g/cm³
• LogP: 2.87280
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 250.11398438
• Heavy Atom Count: 17
• Complexity: 238

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(CN(C)C)COC1=NSC2=CC=CC=C21