3-Pyridinecarboxylicacid, 6-(1-methylethoxy)-


Chemical Name: 3-Pyridinecarboxylicacid, 6-(1-methylethoxy)-
CAS Number: 223127-05-7
Product Number: AG007OVR(AGN-PC-01Z0ZN)
Synonyms:
MDL No:
Molecular Formula: C9H11NO3
Molecular Weight: 181.1885

Identification/Properties


Computed Properties
Molecular Weight:
181.191g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
181.074g/mol
Monoisotopic Mass:
181.074g/mol
Topological Polar Surface Area:
59.4A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
182
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

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NMR Spectrum


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