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

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

CAS No.:
2138311-80-3
Catalog Number:
AG01EK84
Molecular Formula:
C7H9LiN2O3
Molecular Weight:
176.0990
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Product Description
Catalog Number:
AG01EK84
Chemical Name:
lithium(1+) ion 3-tert-butyl-1,2,4-oxadiazole-5-carboxylate
CAS Number:
2138311-80-3
Molecular Formula:
C7H9LiN2O3
Molecular Weight:
176.0990
MDL Number:
MFCD31456960
IUPAC Name:
lithium;3-tert-butyl-1,2,4-oxadiazole-5-carboxylate
InChI:
InChI=1S/C7H10N2O3.Li/c1-7(2,3)6-8-4(5(10)11)12-9-6;/h1-3H3,(H,10,11);/q;+1/p-1
InChI Key:
NHVHKRUVGMETSM-UHFFFAOYSA-M
SMILES:
[O-]C(=O)c1onc(n1)C(C)(C)C.[Li+]
Properties
Complexity:
193  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
176.077g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
176.1g/mol
Monoisotopic Mass:
176.077g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
79A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties