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[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl 3-fluoro-4-methylbenzoate

[3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl 3-fluoro-4-methylbenzoate

Formula: C18H15FN2O3

SMILES: CC1=CC=C(C=C1)C1=NOC(COC(=O)C2=CC=C(C)C(F)=C2)=N1

IUPAC: [3-(4-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl 3-fluoro-4-methylbenzoate

InChI: InChI=1S/C18H15FN2O3/c1-11-3-6-13(7-4-11)17-20-16(24-21-17)10-23-18(22)14-8-5-12(2)15(19)9-14/h3-9H,10H2,1-2H3

Composition: C (66.25%), H (4.63%), F (5.82%), N (8.58%), O (14.71%)

Molar Mass: 326.327

Atom Count: 39

Heavy Atom Count: 24

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 326.106670514
Formal Charge 0
FSP3 0.17
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey XUKKQCVFJUQHNS-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 98.35
Topological Polar Surface Area 65.22
Polarizability 32.94
Ring Count 3
Rotatable Bond Count 5

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Purity LeadTime Formula PacketSize UnitPrice
90% <16 Days C18H15FN2O3 $33.80-$156.00$33.80$52.00$67.60$93.60$156.00
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