4-Hexyloxyphenyl 4-nitrobenzoate

Base Information

• Chemical Name: 4-Hexyloxyphenyl 4-nitrobenzoate
• CAS No.: 68162-10-7
• Molecular Formula: C19H21 N O5
• Molecular Weight: 343.37
• DSSTox Substance ID: DTXSID50389473
• Wikidata: Q82185293
• Mol file: 68162-10-7.mol

Synonyms:4-HEXYLOXYPHENYL 4-NITROBENZOATE;68162-10-7;(4-hexoxyphenyl) 4-nitrobenzoate;4-Nitro-benzoic acid 4-hexyloxy-phenyl ester;4-Hexyloxyphenyl4-nitrobenzoate;SCHEMBL13325797;DTXSID50389473;AKOS000592145;CS-0000226

Chemical Property of 4-Hexyloxyphenyl 4-nitrobenzoate

Chemical Property:

• Vapor Pressure: 5.1E-10mmHg at 25°C
• Boiling Point: 497.1°C at 760 mmHg
• Flash Point: 195.9°C
• PSA: 81.35000
• Density: 1.179g/cm³
• LogP: 5.29630
• XLogP3: 5.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 9
• Exact Mass: 343.14197277
• Heavy Atom Count: 25
• Complexity: 407

Purity/Quality:

98% ^*data from raw suppliers

4-HEXYLOXYPHENYL-4-NITROBENZOATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCOC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)[N+](=O)[O-]