3-Thiophenecarboxylic acid, 4-bromo-


Chemical Name: 3-Thiophenecarboxylic acid, 4-bromo-
CAS Number: 16694-17-0
Product Number: AG001X0I(AGN-PC-0JLVRI)
Synonyms:
MDL No:
Molecular Formula: C5H3BrO2S
Molecular Weight: 207.0451

Identification/Properties


Computed Properties
Molecular Weight:
207.041g/mol
XLogP3:
1.8
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
205.904g/mol
Monoisotopic Mass:
205.904g/mol
Topological Polar Surface Area:
65.5A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
128
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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