(3-Formyl-2-hydroxy-5-nitrophenyl)methyl docosanoate

Base Information

• Chemical Name: (3-Formyl-2-hydroxy-5-nitrophenyl)methyl docosanoate
• CAS No.: 111340-91-1
• Molecular Formula: C30H49NO6
• DSSTox Substance ID: DTXSID50554225
• Wikidata: Q82435131
• Mol file: 111340-91-1.mol

Synonyms:111340-91-1;(3-FORMYL-2-HYDROXY-5-NITROPHENYL)METHYL DOCOSANOATE;SCHEMBL8703328;DTXSID50554225

Chemical Property of (3-Formyl-2-hydroxy-5-nitrophenyl)methyl docosanoate

Chemical Property:

• XLogP3: 11.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 24
• Exact Mass: 519.35598828
• Heavy Atom Count: 37
• Complexity: 593

Purity/Quality:

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCCCCCCCCCCCCC(=O)OCC1=C(C(=CC(=C1)[N+](=O)[O-])C=O)O

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