3-Pyridinecarboxylic acid, 5-(methylamino)-, methyl ester


Chemical Name: 3-Pyridinecarboxylic acid, 5-(methylamino)-, methyl ester
CAS Number: 91702-86-2
Product Number: AG003RWR(AGN-PC-02QVZ2)
Synonyms:
MDL No: MFCD18256217
Molecular Formula: C8H10N2O2
Molecular Weight: 166.1772

Identification/Properties


Computed Properties
Molecular Weight:
166.18g/mol
XLogP3:
0.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
166.074g/mol
Monoisotopic Mass:
166.074g/mol
Topological Polar Surface Area:
51.2A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
161
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#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P280-P301+P312-P302+P352-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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