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Home > Pyridines > 1378717-16-8
1378717-16-8 | 2-(pyridin-2-yl)pentanoic acid
CAS No: 1378717-16-8 Catalog No: AG01B7XQ MDL No:MFCD20660964
Product Description
Catalog Number:
AG01B7XQ
Chemical Name:
2-(pyridin-2-yl)pentanoic acid
CAS Number:
1378717-16-8
Molecular Formula:
C10H13NO2
Molecular Weight:
179.2157
MDL Number:
MFCD20660964
IUPAC Name:
2-pyridin-2-ylpentanoic acid
InChI:
InChI=1S/C10H13NO2/c1-2-5-8(10(12)13)9-6-3-4-7-11-9/h3-4,6-8H,2,5H2,1H3,(H,12,13)
InChI Key:
AKOLZRYXSRTLAS-UHFFFAOYSA-N
SMILES:
CCCC(c1ccccn1)C(=O)O
Properties
Complexity:
170
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.095g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
179.219g/mol
Monoisotopic Mass:
179.095g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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