ethyl 2-(2-bromophenyl)-1,3-oxazole-4-carboxylate

ethyl 2-(2-bromophenyl)-1,3-oxazole-4-carboxylate

CAS: 885274-67-9

Formula: C12H10BrNO3

SMILES: CCOC(=O)C1=COC(=N1)C1=CC=CC=C1Br

IUPAC: ethyl 2-(2-bromophenyl)-1,3-oxazole-4-carboxylate

InChI: InChI=1S/C12H10BrNO3/c1-2-16-12(15)10-7-17-11(14-10)8-5-3-4-6-9(8)13/h3-7H,2H2,1H3

Composition: C (48.67%), H (3.40%), Br (26.98%), N (4.73%), O (16.21%)

Molar Mass: 296.12

Atom Count: 27

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	294.984406
Formal Charge	0
FSP3	0.17
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	JKNMLLKRWOENTR-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	75.89
Topological Polar Surface Area	52.33
Polarizability	25.72
Ring Count	2
Rotatable Bond Count	4

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97%	<2 Days	885274-67-9		$179.40-$4,597.70$179.40$243.80$373.75$631.35$1,147.70$4,597.70