1-{[(benzyloxy)carbonyl]amino}cyclobutane-1-carboxylic acid

1-{[(benzyloxy)carbonyl]amino}cyclobutane-1-carboxylic acid

CAS: 190004-53-6

Formula: C13H15NO4

SMILES: OC(=O)C1(CCC1)NC(=O)OCC1=CC=CC=C1

IUPAC: 1-{[(benzyloxy)carbonyl]amino}cyclobutane-1-carboxylic acid

InChI: InChI=1S/C13H15NO4/c15-11(16)13(7-4-8-13)14-12(17)18-9-10-5-2-1-3-6-10/h1-3,5-6H,4,7-9H2,(H,14,17)(H,15,16)

Composition: C (62.64%), H (6.07%), N (5.62%), O (25.67%)

Molar Mass: 249.266

Atom Count: 33

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	249.100107967
Formal Charge	0
FSP3	0.38
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	GDJSFBNRXFOUEQ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	63.54
Topological Polar Surface Area	75.63
Polarizability	24.95
Ring Count	2
Rotatable Bond Count	5

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