1H-Pyrrole-2-propanoic acid, 3,5-dimethyl-4-(1-oxooctadecyl)-

Base Information

• Chemical Name: 1H-Pyrrole-2-propanoic acid, 3,5-dimethyl-4-(1-oxooctadecyl)-
• CAS No.: 161559-73-5
• Molecular Formula: C27H47NO3
• DSSTox Substance ID: DTXSID60471570
• Nikkaji Number: J813.539H
• Wikidata: Q82300113
• Mol file: 161559-73-5.mol

Synonyms:1H-Pyrrole-2-propanoic acid, 3,5-dimethyl-4-(1-oxooctadecyl)-;161559-73-5;SCHEMBL9262468;DTXSID60471570

Chemical Property of 1H-Pyrrole-2-propanoic acid, 3,5-dimethyl-4-(1-oxooctadecyl)-

Chemical Property:

• XLogP3: 9.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 20
• Exact Mass: 433.35559436
• Heavy Atom Count: 31
• Complexity: 479

Purity/Quality:

99.90% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCCCCCCCCC(=O)C1=C(NC(=C1C)CCC(=O)O)C

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