3-Pyridinecarboxamide, N,N-dimethyl-2-[(phenylmethyl)thio]-


Chemical Name: 3-Pyridinecarboxamide, N,N-dimethyl-2-[(phenylmethyl)thio]-
CAS Number: 112006-57-2
Product Number: AG0092ZQ(AGN-PC-0NFNXL)
Synonyms:
MDL No:
Molecular Formula: C15H16N2OS
Molecular Weight: 272.3653

Identification/Properties


Computed Properties
Molecular Weight:
272.366g/mol
XLogP3:
2.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
4
Exact Mass:
272.098g/mol
Monoisotopic Mass:
272.098g/mol
Topological Polar Surface Area:
58.5A^2
Heavy Atom Count:
19
Formal Charge:
0
Complexity:
290
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:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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