Palythine

Base Information

• Chemical Name: Palythine
• CAS No.: 67731-19-5
• Molecular Formula: C10H16N2O5
• Molecular Weight: 244.24
• DSSTox Substance ID: DTXSID301046391
• Metabolomics Workbench ID: 167632
• Nikkaji Number: J20.041G
• Wikidata: Q104913168,Q104401096
• Mol file: 67731-19-5.mol

Synonyms:palythine

Chemical Property of Palythine

Chemical Property:

• PSA: 122.87000
• LogP: -0.45380
• XLogP3: -1.9
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 4
• Exact Mass: 244.10592162
• Heavy Atom Count: 17
• Complexity: 377

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

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MSDS Files:

Useful:

• Canonical SMILES: COC1=C(CC(CC1=NCC(=O)O)(CO)O)N

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