3-[2-(4-fluorophenyl)-2-oxoethyl]-3-azabicyclo[3.1.0]hexane-2,4-dione

3-[2-(4-fluorophenyl)-2-oxoethyl]-3-azabicyclo[3.1.0]hexane-2,4-dione

CAS: 866151-48-6

Formula: C13H10FNO3

SMILES: FC1=CC=C(C=C1)C(=O)CN1C(=O)C2CC2C1=O

IUPAC: 3-[2-(4-fluorophenyl)-2-oxoethyl]-3-azabicyclo[3.1.0]hexane-2,4-dione

InChI: InChI=1/C13H10FNO3/c14-8-3-1-7(2-4-8)11(16)6-15-12(17)9-5-10(9)13(15)18/h1-4,9-10H,5-6H2

Composition: C (63.16%), H (4.08%), F (7.68%), N (5.67%), O (19.41%)

Molar Mass: 247.225

Atom Count: 28

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	2
Exact Mass	247.064471349
Formal Charge	0
FSP3	0.31
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	WGRUVHUXBRUGFD-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	60.04
Topological Polar Surface Area	54.45
Polarizability	22.87
Ring Count	3
Rotatable Bond Count	3

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90%	<2 Days	866151-48-6		$51.35-$524.40$51.35$63.37$86.31$524.40