2,6-Di(pentan-3-yl)aniline

Base Information

• Chemical Name: 2,6-Di(pentan-3-yl)aniline
• CAS No.: 948587-90-4
• Molecular Formula: C16H27N
• Molecular Weight: 233.39
• European Community (EC) Number: 694-513-2
• DSSTox Substance ID: DTXSID20477412
• Nikkaji Number: J2.482.241I
• Wikidata: Q82309934
• Mol file: 948587-90-4.mol

Synonyms:2,6-Di(pentan-3-yl)aniline;948587-90-4;2,6-bis(pentan-3-yl)aniline;2,6-bis(1-ethylpropyl)aniline;SCHEMBL15874031;DTXSID20477412;WRXMUGOMZOGXCX-UHFFFAOYSA-N;F16073

Chemical Property of 2,6-Di(pentan-3-yl)aniline

Chemical Property:

• Boiling Point: 326.8±11.0 °C(Predicted)
• PKA: 4.69±0.15(Predicted)
• PSA: 26.02000
• Density: 0.905±0.06 g/cm3(Predicted)
• LogP: 5.65720
• Storage Temp.: 2-8°C(protect from light)
• XLogP3: 5.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 6
• Exact Mass: 233.214349865
• Heavy Atom Count: 17
• Complexity: 174

Purity/Quality:

99% ^*data from raw suppliers

2,6-Di(pentan-3-yl)aniline 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(CC)C1=C(C(=CC=C1)C(CC)CC)N