3-Hydroxymethylphenytoin valproic acid ester

Base Information

• Chemical Name: 3-Hydroxymethylphenytoin valproic acid ester
• CAS No.: 189210-81-9
• Molecular Formula: C24H28N2O4
• Molecular Weight: 408.4901
• DSSTox Substance ID: DTXSID70172324
• Nikkaji Number: J821.784J
• Wikidata: Q83042427

Synonyms:3-hydroxymethylphenytoin valproic acid ester;VAL-PHT

Chemical Property of 3-Hydroxymethylphenytoin valproic acid ester

Chemical Property:

• Density: 1.158g/cm³
• XLogP3: 5.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 10
• Exact Mass: 408.20490738
• Heavy Atom Count: 30
• Complexity: 584

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCC(CCC)C(=O)OCN1C(=O)C(NC1=O)(C2=CC=CC=C2)C3=CC=CC=C3

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