Thieno[3,4-b]pyridine-7-carboxylicacid, 4-hydroxy-2-(trifluoromethyl)-, methyl ester


Chemical Name: Thieno[3,4-b]pyridine-7-carboxylicacid, 4-hydroxy-2-(trifluoromethyl)-, methyl ester
CAS Number: 175203-39-1
Product Number: AG0020JF(AGN-PC-0QAQTL)
Synonyms:
MDL No:
Molecular Formula: C10H6F3NO3S
Molecular Weight: 277.2197

Identification/Properties


Computed Properties
Molecular Weight:
277.217g/mol
XLogP3:
2.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
8
Rotatable Bond Count:
2
Exact Mass:
277.002g/mol
Monoisotopic Mass:
277.002g/mol
Topological Polar Surface Area:
83.6A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
421
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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