Home Other Building Blocks lithium(1+) ion 2-(4-cyanopyridin-2-yl)acetate

lithium(1+) ion 2-(4-cyanopyridin-2-yl)acetate

CAS No.:
2126162-51-2
Catalog Number:
AG01EK3L
Molecular Formula:
C8H5LiN2O2
Molecular Weight:
168.0785
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Product Description
Catalog Number:
AG01EK3L
Chemical Name:
lithium(1+) ion 2-(4-cyanopyridin-2-yl)acetate
CAS Number:
2126162-51-2
Molecular Formula:
C8H5LiN2O2
Molecular Weight:
168.0785
MDL Number:
MFCD31381352
IUPAC Name:
lithium;2-(4-cyanopyridin-2-yl)acetate
InChI:
InChI=1S/C8H6N2O2.Li/c9-5-6-1-2-10-7(3-6)4-8(11)12;/h1-3H,4H2,(H,11,12);/q;+1/p-1
InChI Key:
VJXUEGQLIFYTPN-UHFFFAOYSA-M
SMILES:
[O-]C(=O)Cc1cc(ccn1)C#N.[Li+]
Properties
Complexity:
223  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.051g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
168.08g/mol
Monoisotopic Mass:
168.051g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
76.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties