tert-butyl 4-(2-methoxy-2-oxoethylidene)piperidine-1-carboxylate

tert-butyl 4-(2-methoxy-2-oxoethylidene)piperidine-1-carboxylate

CAS: 169206-65-9

Formula: C13H21NO4

SMILES: COC(=O)C=C1CCN(CC1)C(=O)OC(C)(C)C

IUPAC: tert-butyl 4-(2-methoxy-2-oxoethylidene)piperidine-1-carboxylate

InChI: InChI=1S/C13H21NO4/c1-13(2,3)18-12(16)14-7-5-10(6-8-14)9-11(15)17-4/h9H,5-8H2,1-4H3

Composition: C (61.16%), H (8.29%), N (5.49%), O (25.07%)

Molar Mass: 255.314

Atom Count: 39

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	255.14705816
Formal Charge	0
FSP3	0.69
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	OHLLSFRHFHSUES-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	68.24
Topological Polar Surface Area	55.84
Polarizability	26.41
Ring Count	1
Rotatable Bond Count	4

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