1-amino-3-(benzyloxy)cyclobutane-1-carboxylic acid

1-amino-3-(benzyloxy)cyclobutane-1-carboxylic acid

CAS: 191110-50-6

Formula: C12H15NO3

SMILES: NC1(CC(C1)OCC1=CC=CC=C1)C(O)=O

IUPAC: 1-amino-3-(benzyloxy)cyclobutane-1-carboxylic acid

InChI: InChI=1S/C12H15NO3/c13-12(11(14)15)6-10(7-12)16-8-9-4-2-1-3-5-9/h1-5,10H,6-8,13H2,(H,14,15)

Composition: C (65.14%), H (6.83%), N (6.33%), O (21.69%)

Molar Mass: 221.256

Atom Count: 31

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	221.105193347
Formal Charge	0
FSP3	0.42
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	QIBHSXMRVAAKPX-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	58.8
Topological Polar Surface Area	72.55
Polarizability	23.38
Ring Count	2
Rotatable Bond Count	4

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97%	<7 Days	191110-50-6		$203.90-$575.46$203.90$352.94$575.46

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