L-Isoleucine, N-(1-oxopentadecyl)-

Base Information

• Chemical Name: L-Isoleucine, N-(1-oxopentadecyl)-
• CAS No.: 55953-50-9
• Molecular Formula: C21H41NO3
• Molecular Weight: 355.55500
• DSSTox Substance ID: DTXSID90436571
• Wikidata: Q82251860
• Mol file: 55953-50-9.mol

Synonyms:L-Isoleucine, N-(1-oxopentadecyl)-;55953-50-9;SCHEMBL5181466;DTXSID90436571

Chemical Property of L-Isoleucine, N-(1-oxopentadecyl)-

Chemical Property:

• PSA: 69.89000
• LogP: 6.53340
• XLogP3: 7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 17
• Exact Mass: 355.30864417
• Heavy Atom Count: 25
• Complexity: 344

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCCCCCC(=O)NC(C(C)CC)C(=O)O
• Isomeric SMILES: CCCCCCCCCCCCCCC(=O)N[C@@H]([C@@H](C)CC)C(=O)O