Home Carboxys 6-(pyrrolidine-1-carbonyl)pyridine-2-carboxylic acid

6-(pyrrolidine-1-carbonyl)pyridine-2-carboxylic acid

CAS No.:
1153759-48-8
Catalog Number:
AG01AJUW
Molecular Formula:
C11H12N2O3
Molecular Weight:
220.2246
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Product Description
Catalog Number:
AG01AJUW
Chemical Name:
6-(pyrrolidine-1-carbonyl)pyridine-2-carboxylic acid
CAS Number:
1153759-48-8
Molecular Formula:
C11H12N2O3
Molecular Weight:
220.2246
MDL Number:
MFCD12137832
IUPAC Name:
6-(pyrrolidine-1-carbonyl)pyridine-2-carboxylic acid
InChI:
InChI=1S/C11H12N2O3/c14-10(13-6-1-2-7-13)8-4-3-5-9(12-8)11(15)16/h3-5H,1-2,6-7H2,(H,15,16)
InChI Key:
VHRINNVKMJWRHB-UHFFFAOYSA-N
SMILES:
O=C(c1cccc(n1)C(=O)O)N1CCCC1
Properties
Complexity:
287  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.085g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
220.228g/mol
Monoisotopic Mass:
220.085g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
70.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties