2-bromo-4-(trifluoromethyl)-1,3-oxazole

2-bromo-4-(trifluoromethyl)-1,3-oxazole

CAS: 1060816-14-9

Formula: C4HBrF3NO

SMILES: FC(F)(F)C1=COC(Br)=N1

IUPAC: 2-bromo-4-(trifluoromethyl)-1,3-oxazole

InChI: InChI=1S/C4HBrF3NO/c5-3-9-2(1-10-3)4(6,7)8/h1H

Composition: C (22.25%), H (0.47%), Br (37.00%), F (26.39%), N (6.49%), O (7.41%)

Molar Mass: 215.957

Atom Count: 11

Heavy Atom Count: 10

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	214.919361
Formal Charge	0
FSP3	0.25
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	GOJLDYZMFAQWAN-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	29.99
Topological Polar Surface Area	26.03
Polarizability	11.44
Ring Count	1
Rotatable Bond Count	1

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