tert-butyl 3-[(methanesulfonyloxy)methyl]piperidine-1-carboxylate

tert-butyl 3-[(methanesulfonyloxy)methyl]piperidine-1-carboxylate

CAS: 162166-99-6

Formula: C12H23NO5S

SMILES: CC(C)(C)OC(=O)N1CCCC(COS(C)(=O)=O)C1

IUPAC: tert-butyl 3-[(methanesulfonyloxy)methyl]piperidine-1-carboxylate

InChI: InChI=1/C12H23NO5S/c1-12(2,3)18-11(14)13-7-5-6-10(8-13)9-17-19(4,15)16/h10H,5-9H2,1-4H3

Composition: C (49.13%), H (7.90%), N (4.77%), O (27.27%), S (10.93%)

Molar Mass: 293.38

Atom Count: 42

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	293.129694019
Formal Charge	0
FSP3	0.92
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	NEZJCDLNARUJSX-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	70.88
Topological Polar Surface Area	72.91
Polarizability	28.98
Ring Count	1
Rotatable Bond Count	5

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