4-Nitrophenyl 4-heptylbenzoate

Base Information

• Chemical Name: 4-Nitrophenyl 4-heptylbenzoate
• CAS No.: 80292-12-2
• Molecular Formula: C20H23NO4
• DSSTox Substance ID: DTXSID10391890
• Wikidata: Q82189667
• ChEMBL ID: CHEMBL1224481

Synonyms:4-nitrophenyl 4-heptylbenzoate;(4-nitrophenyl) 4-heptylbenzoate;80292-12-2;VH01;CHEMBL1224481;DTXSID10391890;AKOS001584208

Chemical Property of 4-Nitrophenyl 4-heptylbenzoate

Chemical Property:

• XLogP3: 6.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 9
• Exact Mass: 341.16270821
• Heavy Atom Count: 25
• Complexity: 404

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)[N+](=O)[O-]

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