2-(2-Methylbenzyl)azepane

Base Information

• Chemical Name: 2-(2-Methylbenzyl)azepane
• CAS No.: 383129-31-5
• Molecular Formula: C₁₄H₂₁N
• Molecular Weight: 203.327
• DSSTox Substance ID: DTXSID30397814
• Mol file: 383129-31-5.mol

Synonyms:2-(2-methylbenzyl)azepane;383129-31-5;2-[(2-methylphenyl)methyl]azepane;1H-Azepine,hexahydro-2-[(2-methylphenyl)methyl]-;Benzenamine,2-bromo-4-nitro-;SCHEMBL23459399;DTXSID30397814;BBL021208;STK893914;AKOS005143970

Chemical Property of 2-(2-Methylbenzyl)azepane

Chemical Property:

• PSA: 12.03000
• LogP: 3.39850
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 203.167399674
• Heavy Atom Count: 15
• Complexity: 178

Purity/Quality:

99% ^*data from raw suppliers

2-(2-methylbenzyl)azepane ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=CC=C1CC2CCCCCN2