5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid


Chemical Name: 5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carboxylic acid
CAS Number: 101667-97-4
Product Number: AG000541(AGN-PC-0JQR0O)
Synonyms:
MDL No:
Molecular Formula: C8H6N2O3S
Molecular Weight: 210.2098

Identification/Properties


Computed Properties
Molecular Weight:
210.207g/mol
XLogP3:
0.9
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
1
Exact Mass:
210.01g/mol
Monoisotopic Mass:
210.01g/mol
Topological Polar Surface Area:
107A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
318
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


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