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2-(4-fluorophenyl)-2-oxoethyl 3-[(2,5-dimethylphenyl)carbamoyl]propanoate

2-(4-fluorophenyl)-2-oxoethyl 3-[(2,5-dimethylphenyl)carbamoyl]propanoate

Formula: C20H20FNO4

SMILES: CC1=CC=C(C)C(NC(=O)CCC(=O)OCC(=O)C2=CC=C(F)C=C2)=C1

IUPAC: 2-(4-fluorophenyl)-2-oxoethyl 3-[(2,5-dimethylphenyl)carbamoyl]propanoate

InChI: InChI=1S/C20H20FNO4/c1-13-3-4-14(2)17(11-13)22-19(24)9-10-20(25)26-12-18(23)15-5-7-16(21)8-6-15/h3-8,11H,9-10,12H2,1-2H3,(H,22,24)

Composition: C (67.22%), H (5.64%), F (5.32%), N (3.92%), O (17.91%)

Molar Mass: 357.381

Atom Count: 46

Heavy Atom Count: 26

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 357.137636291
Formal Charge 0
FSP3 0.25
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 1
InChIKey WMGIFNHZMXXXDN-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 96.78
Topological Polar Surface Area 72.47
Polarizability 36.21
Ring Count 2
Rotatable Bond Count 8

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C20H20FNO4 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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