Home Carboxys lithium(1+) ion 5-(trifluoromethyl)-1,3,4-oxadiazole-2-carboxylate

lithium(1+) ion 5-(trifluoromethyl)-1,3,4-oxadiazole-2-carboxylate

CAS No.:
1989659-48-4
Catalog Number:
AG01B6A9
Molecular Formula:
C4F3LiN2O3
Molecular Weight:
187.9906
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Product Description
Catalog Number:
AG01B6A9
Chemical Name:
lithium(1+) ion 5-(trifluoromethyl)-1,3,4-oxadiazole-2-carboxylate
CAS Number:
1989659-48-4
Molecular Formula:
C4F3LiN2O3
Molecular Weight:
187.9906
MDL Number:
MFCD30342789
IUPAC Name:
lithium;5-(trifluoromethyl)-1,3,4-oxadiazole-2-carboxylate
InChI:
InChI=1S/C4HF3N2O3.Li/c5-4(6,7)3-9-8-1(12-3)2(10)11;/h(H,10,11);/q;+1/p-1
InChI Key:
WELTYAVCYKRLHV-UHFFFAOYSA-M
SMILES:
[O-]C(=O)c1nnc(o1)C(F)(F)F.[Li+]
Properties
Complexity:
200  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.002g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
187.99g/mol
Monoisotopic Mass:
188.002g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
79A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties