Butoctamide semisuccinate

Base Information

• Chemical Name: Butoctamide semisuccinate
• CAS No.: 32838-28-1
• Molecular Formula: C16H29 N O5
• Molecular Weight: 315.46
• UNII: F58251NT6M
• DSSTox Substance ID: DTXSID4057716
• Nikkaji Number: J22.674B
• Wikidata: Q27114277
• Metabolomics Workbench ID: 67434
• ChEMBL ID: CHEMBL3560122
• Mol file: 32838-28-1.mol

Synonyms:BUTHS;butoctamide hydrogen succinate;butoctamide hydrogen succinate, calcium salt (2:1);butoctamide hydrogen succinate, monosodium salt;butoctamide succinate

Chemical Property of Butoctamide semisuccinate

Chemical Property:

• Melting Point: 46.5°
• Refractive Index: 1.4909 (estimate)
• Boiling Point: 514.6°Cat760mmHg
• PKA: 4.38±0.17(Predicted)
• Flash Point: 265°C
• PSA: 96.19000
• Density: 1.06g/cm³
• LogP: 3.34590
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 13
• Exact Mass: 315.20457303
• Heavy Atom Count: 22
• Complexity: 356

Purity/Quality:

99% ^*data from raw suppliers

4-((4-((2-Ethylhexyl)amino)-4-oxobutan-2-yl)oxy)-4-oxobutanoicacid 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCC(CC)CNC(=O)CC(C)OC(=O)CCC(=O)O
• Description: Butoctamide hydrogensuccinate is a structurally novel hypnotic agent useful in the treatment of insomnia. Unlike other marketed hypnotics, butoctamide appears to increase REM sleep.
• Uses: Butoctamide Hydrogen Succinate was an identified analyte in a non-target analysis of household dust and laundry dryer lint.