1-(4-Hydroxy-4,4-diphenylbut-2-yn-1-yl)-3,4-dihydro-2H-pyrrol-1-ium dihydrogen phosphate

Base Information

• Chemical Name: 1-(4-Hydroxy-4,4-diphenylbut-2-yn-1-yl)-3,4-dihydro-2H-pyrrol-1-ium dihydrogen phosphate
• CAS No.: 54118-66-0
• Molecular Formula: C20H22NO5P
• Molecular Weight: 387.3661
• DSSTox Substance ID: DTXSID10969013
• Mol file: 54118-66-0.mol

Synonyms:DTXSID10969013;1-(4-Hydroxy-4,4-diphenylbut-2-yn-1-yl)-3,4-dihydro-2H-pyrrol-1-ium dihydrogen phosphate

Chemical Property of 1-(4-Hydroxy-4,4-diphenylbut-2-yn-1-yl)-3,4-dihydro-2H-pyrrol-1-ium dihydrogen phosphate

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 116.70000
• Density: g/cm³
• LogP: 2.90740
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 387.12355980
• Heavy Atom Count: 27
• Complexity: 486

Purity/Quality:

98%,99%, ^*data from raw suppliers

ButinolinePhosphate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC=[N+](C1)CC#CC(C2=CC=CC=C2)(C3=CC=CC=C3)O.OP(=O)(O)[O-]
• Uses: Butinoline Phosphate is used in various synthetic preparation of pharmaceutical goods that exhibit potential therapeutic value.