4-Bromo-2-(trifluoromethyl)-1-benzothiophene


Chemical Name: 4-Bromo-2-(trifluoromethyl)-1-benzothiophene
CAS Number: 1609047-47-3
Product Number: AG01DD4E(AG01DD4E)
Synonyms:
MDL No:
Molecular Formula: C9H4BrF3S
Molecular Weight: 281.0923

Identification/Properties


Computed Properties
Molecular Weight:
281.09g/mol
XLogP3:
4.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
0
Exact Mass:
279.917g/mol
Monoisotopic Mass:
279.917g/mol
Topological Polar Surface Area:
28.2A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
219
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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