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methyl 4-[2-(4-fluorophenyl)-2-oxoethoxy]benzoate

methyl 4-[2-(4-fluorophenyl)-2-oxoethoxy]benzoate

Formula: C16H13FO4

SMILES: COC(=O)C1=CC=C(OCC(=O)C2=CC=C(F)C=C2)C=C1

IUPAC: methyl 4-[2-(4-fluorophenyl)-2-oxoethoxy]benzoate

InChI: InChI=1S/C16H13FO4/c1-20-16(19)12-4-8-14(9-5-12)21-10-15(18)11-2-6-13(17)7-3-11/h2-9H,10H2,1H3

Composition: C (66.66%), H (4.55%), F (6.59%), O (22.20%)

Molar Mass: 288.274

Atom Count: 34

Heavy Atom Count: 21

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 288.079787062
Formal Charge 0
FSP3 0.12
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey YUUDREWKWNUNCU-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 74.66
Topological Polar Surface Area 52.6
Polarizability 28.45
Ring Count 2
Rotatable Bond Count 6

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C16H13FO4 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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