ethyl 1-methanesulfonylpiperidine-3-carboxylate

ethyl 1-methanesulfonylpiperidine-3-carboxylate

CAS: 349625-89-4

Formula: C9H17NO4S

SMILES: CCOC(=O)C1CCCN(C1)S(C)(=O)=O

IUPAC: ethyl 1-methanesulfonylpiperidine-3-carboxylate

InChI: InChI=1/C9H17NO4S/c1-3-14-9(11)8-5-4-6-10(7-8)15(2,12)13/h8H,3-7H2,1-2H3

Composition: C (45.94%), H (7.28%), N (5.95%), O (27.20%), S (13.63%)

Molar Mass: 235.3

Atom Count: 32

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	235.087829205
Formal Charge	0
FSP3	0.89
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	RERFXHAKRMBYIH-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	55.61
Topological Polar Surface Area	63.68
Polarizability	22.76
Ring Count	1
Rotatable Bond Count	3

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