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3-bromo-2-(4-fluorophenyl)-5H,6H,7H-pyrazolo[3,2-b][1,3]oxazine

3-bromo-2-(4-fluorophenyl)-5H,6H,7H-pyrazolo[3,2-b][1,3]oxazine

Formula: C12H10BrFN2O

SMILES: FC1=CC=C(C=C1)C1=NN2CCCOC2=C1Br

IUPAC: 3-bromo-2-(4-fluorophenyl)-5H,6H,7H-pyrazolo[3,2-b][1,3]oxazine

InChI: InChI=1S/C12H10BrFN2O/c13-10-11(8-2-4-9(14)5-3-8)15-16-6-1-7-17-12(10)16/h2-5H,1,6-7H2

Composition: C (48.51%), H (3.39%), Br (26.89%), F (6.39%), N (9.43%), O (5.38%)

Molar Mass: 297.127

Atom Count: 27

Heavy Atom Count: 17

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 295.996054
Formal Charge 0
FSP3 0.25
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey CXEMAQKHSSUHHS-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 76.18
Topological Polar Surface Area 27.05
Polarizability 25.98
Ring Count 3
Rotatable Bond Count 1

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Purity (%)
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Molecule Market Select
Purity LeadTime Formula UnitPrice
98% <10 Days C12H10BrFN2O Quote Only