2-Thiophenecarboxylic acid, 5-bromo-3-nitro-


Chemical Name: 2-Thiophenecarboxylic acid, 5-bromo-3-nitro-
CAS Number: 101079-64-5
Product Number: AG0003NW(AGN-PC-05IZ2A)
Synonyms:
MDL No:
Molecular Formula: C5H2BrNO4S
Molecular Weight: 252.0427

Identification/Properties


Computed Properties
Molecular Weight:
252.038g/mol
XLogP3:
2.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
1
Exact Mass:
250.889g/mol
Monoisotopic Mass:
250.889g/mol
Topological Polar Surface Area:
111A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
218
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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