5-Bromo-4-chloro-2-thiophenecarboxylic acid


Chemical Name: 5-Bromo-4-chloro-2-thiophenecarboxylic acid
CAS Number: 123418-69-9
Product Number: AG000KJV(AGN-PC-013NW3)
Synonyms:
MDL No:
Molecular Formula: C5H2BrClO2S
Molecular Weight: 241.4902

Identification/Properties


Computed Properties
Molecular Weight:
241.483g/mol
XLogP3:
3.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
239.865g/mol
Monoisotopic Mass:
239.865g/mol
Topological Polar Surface Area:
65.5A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
155
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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