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tert-butyl 6,6-dioxo-7-oxa-6??-thia-5-azaspiro[3.4]octane-5-carboxylate

tert-butyl 6,6-dioxo-7-oxa-6??-thia-5-azaspiro[3.4]octane-5-carboxylate

CAS: 2227204-96-6

Formula: C10H17NO5S

SMILES: CC(C)(C)OC(=O)N1C2(CCC2)COS1(=O)=O

IUPAC: tert-butyl 6,6-dioxo-7-oxa-6??-thia-5-azaspiro[3.4]octane-5-carboxylate

InChI: InChI=1S/C10H17NO5S/c1-9(2,3)16-8(12)11-10(5-4-6-10)7-15-17(11,13)14/h4-7H2,1-3H3

Composition: C (45.62%), H (6.51%), N (5.32%), O (30.38%), S (12.18%)

Molar Mass: 263.31

Atom Count: 34

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 263.082743825
Formal Charge 0
FSP3 0.9
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 0
InChIKey QNQYINKTZPUUMY-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 59.41
Topological Polar Surface Area 72.91
Polarizability 24.63
Ring Count 2
Rotatable Bond Count 2

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