3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide

3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide

CAS: 4415-11-6

Formula: C11H8ClFN2O2

SMILES: CC1=C(C(N)=O)C(=NO1)C1=C(Cl)C=CC=C1F

IUPAC: 3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide

InChI: InChI=1S/C11H8ClFN2O2/c1-5-8(11(14)16)10(15-17-5)9-6(12)3-2-4-7(9)13/h2-4H,1H3,(H2,14,16)

Composition: C (51.88%), H (3.17%), Cl (13.92%), F (7.46%), N (11.00%), O (12.57%)

Molar Mass: 254.65

Atom Count: 25

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	254.0258334
Formal Charge	0
FSP3	0.09
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	PPKCMGUTHICRLU-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	61.51
Topological Polar Surface Area	69.12
Polarizability	23.51
Ring Count	2
Rotatable Bond Count	1

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