methyl 5-(2,4-difluorophenyl)-1,2-oxazole-3-carboxylate

methyl 5-(2,4-difluorophenyl)-1,2-oxazole-3-carboxylate

CAS: 1105191-49-8

Formula: C11H7F2NO3

SMILES: COC(=O)C1=NOC(=C1)C1=CC=C(F)C=C1F

IUPAC: methyl 5-(2,4-difluorophenyl)-1,2-oxazole-3-carboxylate

InChI: InChI=1S/C11H7F2NO3/c1-16-11(15)9-5-10(17-14-9)7-3-2-6(12)4-8(7)13/h2-5H,1H3

Composition: C (55.24%), H (2.95%), F (15.89%), N (5.86%), O (20.07%)

Molar Mass: 239.178

Atom Count: 24

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	239.039399415
Formal Charge	0
FSP3	0.09
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	FVQQUERDPUGSJW-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	54.6
Topological Polar Surface Area	52.33
Polarizability	21.18
Ring Count	2
Rotatable Bond Count	3

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