Home Carbonyls lithium(1+) ion 2-{[(tert-butoxy)carbonyl]amino}pyridine-4-sulfinate

lithium(1+) ion 2-{[(tert-butoxy)carbonyl]amino}pyridine-4-sulfinate

CAS No.:
2138573-46-1
Catalog Number:
AG01EIM1
Molecular Formula:
C10H13LiN2O4S
Molecular Weight:
264.2272
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Product Description
Catalog Number:
AG01EIM1
Chemical Name:
lithium(1+) ion 2-{[(tert-butoxy)carbonyl]amino}pyridine-4-sulfinate
CAS Number:
2138573-46-1
Molecular Formula:
C10H13LiN2O4S
Molecular Weight:
264.2272
MDL Number:
MFCD31559474
IUPAC Name:
lithium;2-[(2-methylpropan-2-yl)oxycarbonylamino]pyridine-4-sulfinate
InChI:
InChI=1S/C10H14N2O4S.Li/c1-10(2,3)16-9(13)12-8-6-7(17(14)15)4-5-11-8;/h4-6H,1-3H3,(H,14,15)(H,11,12,13);/q;+1/p-1
InChI Key:
PRXFLLOHQZJFEL-UHFFFAOYSA-M
SMILES:
O=C(Nc1nccc(c1)S(=O)[O-])OC(C)(C)C.[Li+]
Properties
Complexity:
309  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.076g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
264.224g/mol
Monoisotopic Mass:
264.076g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
111A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties