1H-Thieno[2,3-c]pyrazole-5-carboxylic acid, 1-methyl-3-phenyl-


Chemical Name: 1H-Thieno[2,3-c]pyrazole-5-carboxylic acid, 1-methyl-3-phenyl-
CAS Number: 25252-47-5
Product Number: AG00C27I(AGN-PC-0KKQ1P)
Synonyms:
MDL No:
Molecular Formula: C13H10N2O2S
Molecular Weight: 258.2957

Identification/Properties


Properties
MP:
267-270 °C
BP:
502.9°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
258.295g/mol
XLogP3:
3.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
258.046g/mol
Monoisotopic Mass:
258.046g/mol
Topological Polar Surface Area:
83.4A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
333
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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