Thieno[3,4-b]thiophene-2-carboxylic acid


Chemical Name: Thieno[3,4-b]thiophene-2-carboxylic acid
CAS Number: 14630-08-1
Product Number: AG001DVI(AGN-PC-03FB6H)
Synonyms:
MDL No:
Molecular Formula: C7H4O2S2
Molecular Weight: 184.2355

Identification/Properties


Computed Properties
Molecular Weight:
184.2g/mol
XLogP3:
2.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
183.965272g/mol
Monoisotopic Mass:
183.965272g/mol
Topological Polar Surface Area:
93.8Ų
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
183
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:
H317-H319
Precautionary Statements:
P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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