methyl 3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoate

methyl 3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoate

CAS: 775304-60-4

Formula: C16H11FN2O3

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

IUPAC: methyl 3-[5-(2-fluorophenyl)-1,2,4-oxadiazol-3-yl]benzoate

InChI: InChI=1S/C16H11FN2O3/c1-21-16(20)11-6-4-5-10(9-11)14-18-15(22-19-14)12-7-2-3-8-13(12)17/h2-9H,1H3

Composition: C (64.43%), H (3.72%), F (6.37%), N (9.39%), O (16.09%)

Molar Mass: 298.273

Atom Count: 33

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	298.075370385
Formal Charge	0
FSP3	0.06
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	LFJJTHGQRVVGGN-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	99.43
Topological Polar Surface Area	65.22
Polarizability	30.09
Ring Count	3
Rotatable Bond Count	4

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