2,3-Dibromopropyl dihydrogen phosphate

Base Information

• Chemical Name: 2,3-Dibromopropyl dihydrogen phosphate
• CAS No.: 5324-12-9
• Molecular Formula: C3H7Br2O4P
• Molecular Weight: 297.89
• European Community (EC) Number: 226-192-8
• NSC Number: 2862
• UNII: 0KPI8DXT79
• DSSTox Substance ID: DTXSID501017085
• Nikkaji Number: J34.647K
• Wikidata: Q27236912
• Mol file: 5324-12-9.mol

Synonyms:2,3-dibromopropylphosphate;2,3-dibromopropylphosphate, diammonium salt;2,3-dibromopropylphosphate, magnesium salt

Chemical Property of 2,3-Dibromopropyl dihydrogen phosphate

Chemical Property:

• Vapor Pressure: 2.78E-07mmHg at 25°C
• Boiling Point: 393.3°Cat760mmHg
• Flash Point: 191.7°C
• PSA: 76.57000
• Density: 2.285g/cm³
• LogP: 1.25410
• XLogP3: 0
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 297.84282
• Heavy Atom Count: 10
• Complexity: 135

Purity/Quality:

99%, ^*data from raw suppliers

Mono(2,3-dibromopropyl)Phosphate ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(C(CBr)Br)OP(=O)(O)O
• Uses: Mono(2,3-dibromopropyl) Phosphate is a metabolite of Tris(2,3-dibromopropyl) Phosphate (T775560), which is a flame retardant that has previously shown to be a mutagen and carcinogen in experimental animals. Tris(2,3-dibromopropyl) Phosphate is widely used in plastics and textiles. Also related to Bis(2,3-dibromopropyl) Phosphate (B426235).