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450368-20-4 | 6-(Pyrrolidin-1-yl)picolinic acid
CAS No: 450368-20-4 Catalog No: AG0034B7 MDL No:MFCD09064946
Product Description
Catalog Number:
AG0034B7
Chemical Name:
6-(Pyrrolidin-1-yl)picolinic acid
CAS Number:
450368-20-4
Molecular Formula:
C10H12N2O2
Molecular Weight:
192.2145
MDL Number:
MFCD09064946
IUPAC Name:
6-pyrrolidin-1-ylpyridine-2-carboxylic acid
InChI:
InChI=1S/C10H12N2O2/c13-10(14)8-4-3-5-9(11-8)12-6-1-2-7-12/h3-5H,1-2,6-7H2,(H,13,14)
InChI Key:
HXPHLYQBFPDHNK-UHFFFAOYSA-N
SMILES:
OC(=O)c1cccc(n1)N1CCCC1
Properties
Complexity:
214
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.09g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
192.218g/mol
Monoisotopic Mass:
192.09g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
53.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7
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