4,6-dibromothieno[2,3-c]thiophene-2-carboxylic acid


Chemical Name: 4,6-dibromothieno[2,3-c]thiophene-2-carboxylic acid
CAS Number: 1024594-86-2
Product Number: AG0007JE(AGN-PC-0HEV0G)
Synonyms:
MDL No:
Molecular Formula: C7H2Br2O2S2
Molecular Weight: 342.0276

Identification/Properties


Computed Properties
Molecular Weight:
342.019g/mol
XLogP3:
4.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
341.784g/mol
Monoisotopic Mass:
339.786g/mol
Topological Polar Surface Area:
93.8A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
239
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


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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