Home Carboxys sodium 5-oxo-3-(pyridin-2-yl)pyrrolidine-3-carboxylate

sodium 5-oxo-3-(pyridin-2-yl)pyrrolidine-3-carboxylate

CAS No.:
1864060-95-6
Catalog Number:
AG01AUD4
Molecular Formula:
C10H9N2NaO3
Molecular Weight:
228.1798
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Product Description
Catalog Number:
AG01AUD4
Chemical Name:
sodium 5-oxo-3-(pyridin-2-yl)pyrrolidine-3-carboxylate
CAS Number:
1864060-95-6
Molecular Formula:
C10H9N2NaO3
Molecular Weight:
228.1798
MDL Number:
MFCD29034851
IUPAC Name:
sodium;5-oxo-3-pyridin-2-ylpyrrolidine-3-carboxylate
InChI:
InChI=1S/C10H10N2O3.Na/c13-8-5-10(6-12-8,9(14)15)7-3-1-2-4-11-7;/h1-4H,5-6H2,(H,12,13)(H,14,15);/q;+1/p-1
InChI Key:
UJHNFJUQGSPPDQ-UHFFFAOYSA-M
SMILES:
O=C1NCC(C1)(C(=O)[O-])c1ccccn1.[Na+]
Properties
Complexity:
298  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
228.051g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
228.183g/mol
Monoisotopic Mass:
228.051g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
82.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties