2-Bromo-5-fluorobenzo[d]thiazole

HCID 17859396

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Basic information

CAS: 441715-01-1
Standard SMILES: Fc1ccc2sc(Br)nc2c1
InChIKey: CRPBXAYZSUWBMX-UHFFFAOYSA-N
Molecular formula: C7H3BrFNS
Average molar mass: 232.07 g/mol
Monoisotopic mass: 230.91536042

Names & identifiers

Preferred name: 2-Bromo-5-fluorobenzo[d]thiazole
IUPAC: 2-bromo-5-fluoro-1,3-benzothiazole
English name: 2-Bromo-5-fluorobenzothiazole
Molecular formula: C7H3BrFNS
Molecular weight: 232.07

Names & synonyms

2-Bromo-5-fluorobenzo[d]thiazole441715-01-12-BROMO-5-FLUOROBENZOTHIAZOLE2-BROMO-5-FLUORO-1,3-BENZOTHIAZOLEMFCD09749235SCHEMBL2432396DTXSID40591326CRPBXAYZSUWBMX-UHFFFAOYSA-NBenzothiazole, 2-bromo-5-fluoro-AT22785AS-76233SY075685

Show more names

EN300-2366272F431325

Database identifiers

CAS: 441715-01-1
PubChem CID: 17859396
DTXSID: DTXSID40591326

Properties

Computed structural properties

XLogP: 3.5
Topological polar surface area: 41.1 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 3
Rotatable bonds: 0
Heavy atoms: 11
Formal charge: 0
Complexity: 157

Physicochemical properties

Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H315-H319-H335
Precautionary statements: 261 · P261-P280-P301+P312-P302+P352-P305+P351+P338
HS Code: 29342000 · 29342000