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1023816-94-5 | 4-(Piperidin-1-yl)nicotinic acid
CAS No: 1023816-94-5 Catalog No: AG01FEJ6 MDL No:
Product Description
Catalog Number:
AG01FEJ6
Chemical Name:
4-(Piperidin-1-yl)nicotinic acid
CAS Number:
1023816-94-5
Molecular Formula:
C11H14N2O2
Molecular Weight:
206.2411
IUPAC Name:
4-piperidin-1-ylpyridine-3-carboxylic acid
InChI:
InChI=1S/C11H14N2O2/c14-11(15)9-8-12-5-4-10(9)13-6-2-1-3-7-13/h4-5,8H,1-3,6-7H2,(H,14,15)
InChI Key:
QLYGDEGQCUCYNJ-UHFFFAOYSA-N
SMILES:
OC(=O)c1cnccc1N1CCCCC1
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
206.106g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
206.245g/mol
Monoisotopic Mass:
206.106g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
53.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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