5-(2-methylsulfanylphenyl)pyridine-3-carboxylic acid


Chemical Name: 5-(2-methylsulfanylphenyl)pyridine-3-carboxylic acid
CAS Number: 1261964-02-6
Product Number: AG000S9I(AGN-PC-09Q3PI)
Synonyms:
MDL No:
Molecular Formula: C13H11NO2S
Molecular Weight: 245.2969

Identification/Properties


Computed Properties
Molecular Weight:
245.296g/mol
XLogP3:
2.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
245.051g/mol
Monoisotopic Mass:
245.051g/mol
Topological Polar Surface Area:
75.5A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
272
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


Request for Quotation


Customer Feedback