(S)-Furaltadone hydrochloride

Base Information

• Chemical Name: (S)-Furaltadone hydrochloride
• CAS No.: 3031-51-4
• Molecular Formula: C13H16 N4 O6 . Cl H
• Molecular Weight: 360.79
• DSSTox Substance ID: DTXSID4020909
• Mol file: 3031-51-4.mol

Synonyms:(S)-Furaltadone hydrochloride;DTXSID4020909

Chemical Property of (S)-Furaltadone hydrochloride

Chemical Property:

• Vapor Pressure: 1.08E-08mmHg at 25°C
• Boiling Point: 461.4°Cat760mmHg
• Flash Point: 232.8°C
• PSA: 113.33000
• Density: 1.58g/cm³
• LogP: 1.87570
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 4
• Exact Mass: 360.0836620
• Heavy Atom Count: 24
• Complexity: 476

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1COCCN1CC2CN(C(=O)O2)N=CC3=CC=C(O3)[N+](=O)[O-].Cl
• Isomeric SMILES: C1COCCN1C[C@H]2CN(C(=O)O2)N=CC3=CC=C(O3)[N+](=O)[O-].Cl