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1215503-74-4 | 6-(Piperidin-4-ylmethoxy)pyridine-2-carboxylic acid
CAS No: 1215503-74-4 Catalog No: AG01F8P4 MDL No:
Product Description
Catalog Number:
AG01F8P4
Chemical Name:
6-(Piperidin-4-ylmethoxy)pyridine-2-carboxylic acid
CAS Number:
1215503-74-4
Molecular Formula:
C12H16N2O3
Molecular Weight:
236.2670
IUPAC Name:
6-(piperidin-4-ylmethoxy)pyridine-2-carboxylic acid
InChI:
InChI=1S/C12H16N2O3/c15-12(16)10-2-1-3-11(14-10)17-8-9-4-6-13-7-5-9/h1-3,9,13H,4-8H2,(H,15,16)
InChI Key:
GIRPIGFFKSPPMQ-UHFFFAOYSA-N
SMILES:
OC(=O)c1cccc(n1)OCC1CCNCC1
Properties
Complexity:
254
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.116g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
236.271g/mol
Monoisotopic Mass:
236.116g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
71.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.9
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