1,4-Butanedione, 1,4-di-2-thienyl-


Chemical Name: 1,4-Butanedione, 1,4-di-2-thienyl-
CAS Number: 13669-05-1
Product Number: AG001289(AGN-PC-0JPIJN)
Synonyms:
MDL No:
Molecular Formula: C12H10O2S2
Molecular Weight: 250.3366

Identification/Properties


Properties
MP:
133℃
BP:
431°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
250.33g/mol
XLogP3:
2.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
5
Exact Mass:
250.012g/mol
Monoisotopic Mass:
250.012g/mol
Topological Polar Surface Area:
90.6A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
250
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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