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878742-33-7 | 5-(Piperidin-1-yl)nicotinic acid
CAS No: 878742-33-7 Catalog No: AG004E99 MDL No:MFCD06254779
Product Description
Catalog Number:
AG004E99
Chemical Name:
5-(Piperidin-1-yl)nicotinic acid
CAS Number:
878742-33-7
Molecular Formula:
C11H14N2O2
Molecular Weight:
206.2411
MDL Number:
MFCD06254779
IUPAC Name:
5-piperidin-1-ylpyridine-3-carboxylic acid
InChI:
InChI=1S/C11H14N2O2/c14-11(15)9-6-10(8-12-7-9)13-4-2-1-3-5-13/h6-8H,1-5H2,(H,14,15)
InChI Key:
UWDWYCKLOPCIOM-UHFFFAOYSA-N
SMILES:
OC(=O)c1cncc(c1)N1CCCCC1
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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