ethyl 2-(4-methoxyphenoxy)-3-oxobutanoate

ethyl 2-(4-methoxyphenoxy)-3-oxobutanoate

CAS: 7699-85-6

Formula: C13H16O5

SMILES: CCOC(=O)C(OC1=CC=C(OC)C=C1)C(C)=O

IUPAC: ethyl 2-(4-methoxyphenoxy)-3-oxobutanoate

InChI: InChI=1/C13H16O5/c1-4-17-13(15)12(9(2)14)18-11-7-5-10(16-3)6-8-11/h5-8,12H,4H2,1-3H3

Composition: C (61.90%), H (6.39%), O (31.71%)

Molar Mass: 252.266

Atom Count: 34

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	252.099773615
Formal Charge	0
FSP3	0.38
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	PIJKLMFBBJCAOC-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	64.12
Topological Polar Surface Area	61.83
Polarizability	25.45
Ring Count	1
Rotatable Bond Count	7

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90%	<2 Days	7699-85-6		$51.35-$86.31$51.35$63.37$86.31