3-Pyridinecarboxaldehyde, 5-methyl-


Chemical Name: 3-Pyridinecarboxaldehyde, 5-methyl-
CAS Number: 100910-66-5
Product Number: AG000366(AGN-PC-000L9P)
Synonyms:
MDL No:
Molecular Formula: C7H7NO
Molecular Weight: 121.1366

Identification/Properties


Computed Properties
Molecular Weight:
121.139g/mol
XLogP3:
0.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
121.053g/mol
Monoisotopic Mass:
121.053g/mol
Topological Polar Surface Area:
30A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
103
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+H312+H332-H315-H319-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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