ethyl 2-[4-(acetyloxy)phenyl]-2-oxoacetate

ethyl 2-[4-(acetyloxy)phenyl]-2-oxoacetate

CAS: 100519-34-4

Formula: C12H12O5

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

IUPAC: ethyl 2-[4-(acetyloxy)phenyl]-2-oxoacetate

InChI: InChI=1S/C12H12O5/c1-3-16-12(15)11(14)9-4-6-10(7-5-9)17-8(2)13/h4-7H,3H2,1-2H3

Composition: C (61.02%), H (5.12%), O (33.86%)

Molar Mass: 236.223

Atom Count: 29

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	236.068473486
Formal Charge	0
FSP3	0.25
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	YLQROMILHQCUBD-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	58.91
Topological Polar Surface Area	69.67
Polarizability	23
Ring Count	1
Rotatable Bond Count	6

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