N-(3-nitrobenzyl)cycloheptanamine

Base Information

• Chemical Name: N-(3-nitrobenzyl)cycloheptanamine
• CAS No.: 332108-56-2
• Molecular Formula: C14H20N2O2
• Molecular Weight: 248.32
• Hs Code.: 2921499090
• DSSTox Substance ID: DTXSID80355106
• Wikidata: Q82133757
• ChEMBL ID: CHEMBL1327797
• Mol file: 332108-56-2.mol

Synonyms:N-(3-nitrobenzyl)cycloheptanamine;332108-56-2;N-[(3-nitrophenyl)methyl]cycloheptanamine;Cambridge id 5575786;Oprea1_118832;Oprea1_303325;MLS000689203;CHEMBL1327797;DTXSID80355106;HMS2716E08;AKOS000546559;SMR000283233;AB00089979-01;AG-690/11822921

Chemical Property of N-(3-nitrobenzyl)cycloheptanamine

Chemical Property:

• Vapor Pressure: 2.77E-06mmHg at 25°C
• Boiling Point: 389.8°C at 760 mmHg
• Flash Point: 189.6°C
• PSA: 57.85000
• Density: 1.11g/cm³
• LogP: 4.32130
• XLogP3: 3.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 248.152477885
• Heavy Atom Count: 18
• Complexity: 257

Purity/Quality:

98% ^*data from raw suppliers

N-(3-NITROBENZYL)CYCLOHEPTANAMINE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCCC(CC1)NCC2=CC(=CC=C2)[N+](=O)[O-]