Pantonine

Base Information

• Chemical Name: Pantonine
• CAS No.: 470-28-0
• Molecular Formula: C6H13NO3
• Molecular Weight: 147.17
• DSSTox Substance ID: DTXSID30433084
• Wikidata: Q82247208
• Mol file: 470-28-0.mol

Synonyms:Pantonine;470-28-0;SCHEMBL4956090;DTXSID30433084;(2S)-2-amino-4-hydroxy-3,3-dimethylbutanoic acid

Chemical Property of Pantonine

Chemical Property:

• PSA: 83.55000
• LogP: 0.11710
• XLogP3: -3
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 147.08954328
• Heavy Atom Count: 10
• Complexity: 133

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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