Pentyl 2-nitro-5-(2,4,6-trichlorophenoxy)benzoate

Base Information

• Chemical Name: Pentyl 2-nitro-5-(2,4,6-trichlorophenoxy)benzoate
• CAS No.: 57729-12-1
• Molecular Formula: C18H16Cl3NO5
• DSSTox Substance ID: DTXSID80603371
• Wikidata: Q82500745

Synonyms:57729-12-1;PENTYL 2-NITRO-5-(2,4,6-TRICHLOROPHENOXY)BENZOATE;SCHEMBL10785951;DTXSID80603371

Chemical Property of Pentyl 2-nitro-5-(2,4,6-trichlorophenoxy)benzoate

Chemical Property:

• XLogP3: 6.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 8
• Exact Mass: 431.009406
• Heavy Atom Count: 27
• Complexity: 492

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCOC(=O)C1=C(C=CC(=C1)OC2=C(C=C(C=C2Cl)Cl)Cl)[N+](=O)[O-]

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