ethyl 2-(3-chloro-4-fluorophenyl)-2-oxoacetate

ethyl 2-(3-chloro-4-fluorophenyl)-2-oxoacetate

CAS: 845790-53-6

Formula: C10H8ClFO3

SMILES: CCOC(=O)C(=O)C1=CC=C(F)C(Cl)=C1

IUPAC: ethyl 2-(3-chloro-4-fluorophenyl)-2-oxoacetate

InChI: InChI=1S/C10H8ClFO3/c1-2-15-10(14)9(13)6-3-4-8(12)7(11)5-6/h3-5H,2H2,1H3

Composition: C (52.08%), H (3.50%), Cl (15.37%), F (8.24%), O (20.81%)

Molar Mass: 230.62

Atom Count: 23

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	230.0146
Formal Charge	0
FSP3	0.2
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	OVOGFBWMHITCTB-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	52.79
Topological Polar Surface Area	43.37
Polarizability	20.24
Ring Count	1
Rotatable Bond Count	4

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<7 Days	845790-53-6		$105.57-$1,042.25$105.57$137.66$328.10$1,042.25