tert-butyl (4S)-4-methyl-2,2-dioxo-1,2??,3-oxathiazolidine-3-carboxylate

tert-butyl (4S)-4-methyl-2,2-dioxo-1,2??,3-oxathiazolidine-3-carboxylate

CAS: 439948-91-1

Formula: C8H15NO5S

SMILES: C[C@H]1COS(=O)(=O)N1C(=O)OC(C)(C)C

IUPAC: tert-butyl (4S)-4-methyl-2,2-dioxo-1,2??,3-oxathiazolidine-3-carboxylate

InChI: InChI=1S/C8H15NO5S/c1-6-5-13-15(11,12)9(6)7(10)14-8(2,3)4/h6H,5H2,1-4H3/t6-/m0/s1

Composition: C (40.50%), H (6.37%), N (5.90%), O (33.71%), S (13.51%)

Molar Mass: 237.27

Atom Count: 30

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	237.067093761
Formal Charge	0
FSP3	0.87
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	NFAKQWFVEAEEPG-LURJTMIESA-N
Lipinski's Rule of Five	1
Molar Refractivity	52.13
Topological Polar Surface Area	72.91
Polarizability	21.7
Ring Count	1
Rotatable Bond Count	2

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