4,7-Difluoro-5,6-dihydroxytryptamine creatinine

Base Information

• Chemical Name: 4,7-Difluoro-5,6-dihydroxytryptamine creatinine
• CAS No.: 133983-26-3
• Molecular Formula: C14H19F2N5O7S
• Molecular Weight: 439.3917664
• DSSTox Substance ID: DTXSID10158440
• ChEMBL ID: CHEMBL71532
• Mol file: 133983-26-3.mol

Synonyms:4,7-DFDTC;4,7-difluoro-5,6-dihydroxytryptamine creatinine

Chemical Property of 4,7-Difluoro-5,6-dihydroxytryptamine creatinine

Chemical Property:

• Vapor Pressure: 1.44E-08mmHg at 25°C
• Boiling Point: 445.9°Cat760mmHg
• Flash Point: 223.5°C
• PSA: 224.93000
• Density: g/cm³
• LogP: 1.78310
• Hydrogen Bond Donor Count: 7
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 2
• Exact Mass: 439.09732546
• Heavy Atom Count: 29
• Complexity: 490

Purity/Quality:

98%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1CC(=O)N=C1N.C1=C(C2=C(N1)C(=C(C(=C2F)O)O)F)CCN.OS(=O)(=O)O