1-Benzyl-5-nitroindole-3-carbaldehyde

Base Information

• Chemical Name: 1-Benzyl-5-nitroindole-3-carbaldehyde
• CAS No.: 300664-53-3
• Molecular Formula: C16H12 N2 O3
• Molecular Weight: 0
• Hs Code.: 2933998090
• DSSTox Substance ID: DTXSID50370745
• Wikidata: Q82157898
• Mol file: 300664-53-3.mol

Synonyms:300664-53-3;1-benzyl-5-nitroindole-3-carbaldehyde;1-Benzyl-5-nitro-1H-indole-3-carbaldehyde;1-benzyl-5-nitro-1h-3-indolecarbaldehyde;DTXSID50370745

Chemical Property of 1-Benzyl-5-nitroindole-3-carbaldehyde

Chemical Property:

• PSA: 67.82000
• LogP: 3.93350
• XLogP3: 2.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 280.08479225
• Heavy Atom Count: 21
• Complexity: 390

Purity/Quality:

1-BENZYL-5-NITROINDOLE-3-CARBOXALDEHYDE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)CN2C=C(C3=C2C=CC(=C3)[N+](=O)[O-])C=O