5-(3-fluorophenyl)-5-oxopentanoic acid

5-(3-fluorophenyl)-5-oxopentanoic acid

CAS: 845790-38-7

Formula: C11H11FO3

SMILES: OC(=O)CCCC(=O)C1=CC=CC(F)=C1

IUPAC: 5-(3-fluorophenyl)-5-oxopentanoic acid

InChI: InChI=1S/C11H11FO3/c12-9-4-1-3-8(7-9)10(13)5-2-6-11(14)15/h1,3-4,7H,2,5-6H2,(H,14,15)

Composition: C (62.85%), H (5.27%), F (9.04%), O (22.83%)

Molar Mass: 210.204

Atom Count: 26

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	210.069222377
Formal Charge	0
FSP3	0.27
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
InChIKey	VMDBDUOSNLRJAG-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	52.17
Topological Polar Surface Area	54.37
Polarizability	19.84
Ring Count	1
Rotatable Bond Count	5

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<7 Days	845790-38-7		$172.85-$308.43$172.85$308.43