1,5-Dibromo-3-fluoro-2-isothiocyanatobenzene

Base Information

• Chemical Name: 1,5-Dibromo-3-fluoro-2-isothiocyanatobenzene
• CAS No.: 244022-67-1
• Molecular Formula: C7H2Br2FNS
• Molecular Weight: 310.97
• Hs Code.: 2930909090
• DSSTox Substance ID: DTXSID50371590
• Mol file: 244022-67-1.mol

Synonyms:244022-67-1;2,4-Dibromo-6-fluorophenyl isothiocyanate;1,5-dibromo-3-fluoro-2-isothiocyanatobenzene;SCHEMBL2892526;DTXSID50371590;MFCD00832697;AS-9312;FT-0609982;A817281;1,5-bis(bromanyl)-3-fluoranyl-2-isothiocyanato-benzene

Chemical Property of 1,5-Dibromo-3-fluoro-2-isothiocyanatobenzene

Chemical Property:

• Vapor Pressure: 0.000364mmHg at 25°C
• Melting Point: 50 °C
• Refractive Index: 1.649
• Boiling Point: 328.4 °C at 760 mmHg
• Flash Point: 152.4 °C
• PSA: 44.45000
• Density: 1.96 g/cm³
• LogP: 4.08500
• Sensitive.: Stench
• XLogP3: 4.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 310.82382
• Heavy Atom Count: 12
• Complexity: 208

Purity/Quality:

98%min ^*data from raw suppliers

2,4-Dibromo-6-fluorophenylisothiocyanate 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=C(C=C(C(=C1F)N=C=S)Br)Br