2-chloro-6-fluorophenyl 1-ethyl 2-ethylpropanedioate

2-chloro-6-fluorophenyl 1-ethyl 2-ethylpropanedioate

CAS: 190521-88-1

Formula: C13H14ClFO4

SMILES: CCOC(=O)C(CC)C(=O)OC1=C(Cl)C=CC=C1F

IUPAC: 2-chloro-6-fluorophenyl 1-ethyl 2-ethylpropanedioate

InChI: InChI=1/C13H14ClFO4/c1-3-8(12(16)18-4-2)13(17)19-11-9(14)6-5-7-10(11)15/h5-8H,3-4H2,1-2H3

Composition: C (54.08%), H (4.89%), Cl (12.28%), F (6.58%), O (22.17%)

Molar Mass: 288.7

Atom Count: 33

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	288.0564648
Formal Charge	0
FSP3	0.38
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	KREUUACLRJUGMS-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	67.25
Topological Polar Surface Area	52.6
Polarizability	26.45
Ring Count	1
Rotatable Bond Count	7

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97%	<14 Days	190521-88-1		$94.50-$354.38$94.50$354.38