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88940-70-9 | 4-Pyridinepentanoic acid
CAS No: 88940-70-9 Catalog No: AG0047YW MDL No:
Product Description
Catalog Number:
AG0047YW
Chemical Name:
4-Pyridinepentanoic acid
CAS Number:
88940-70-9
Molecular Formula:
C10H13NO2
Molecular Weight:
179.2157
IUPAC Name:
5-pyridin-4-ylpentanoic acid
InChI:
InChI=1S/C10H13NO2/c12-10(13)4-2-1-3-9-5-7-11-8-6-9/h5-8H,1-4H2,(H,12,13)
InChI Key:
DFTPIBFPPYDWEC-UHFFFAOYSA-N
SMILES:
OC(=O)CCCCc1ccncc1
Properties
Complexity:
153
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:
5
Topological Polar Surface Area:
50.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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