ethyl 1-[(tert-butoxycarbonyl)amino]-3-oxocyclobutane-1-carboxylate

ethyl 1-[(tert-butoxycarbonyl)amino]-3-oxocyclobutane-1-carboxylate

CAS: 129287-91-8

Formula: C12H19NO5

SMILES: CCOC(=O)C1(CC(=O)C1)NC(=O)OC(C)(C)C

IUPAC: ethyl 1-{[(tert-butoxy)carbonyl]amino}-3-oxocyclobutane-1-carboxylate

InChI: InChI=1S/C12H19NO5/c1-5-17-9(15)12(6-8(14)7-12)13-10(16)18-11(2,3)4/h5-7H2,1-4H3,(H,13,16)

Composition: C (56.02%), H (7.44%), N (5.44%), O (31.09%)

Molar Mass: 257.286

Atom Count: 37

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	0
Exact Mass	257.126322716
Formal Charge	0
FSP3	0.75
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	DFSYSSVVPOGHSO-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	62.58
Topological Polar Surface Area	81.7
Polarizability	24.96
Ring Count	1
Rotatable Bond Count	6

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