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5-bromo-2-[(4R)-4-isopropyl-4,5-dihydro-1,3-oxazol-2-yl]pyridine

5-bromo-2-[(4R)-4-isopropyl-4,5-dihydro-1,3-oxazol-2-yl]pyridine

CAS: 2757083-30-8

Formula: C11H13BrN2O

SMILES: CC(C)[C@@H]1COC(=N1)C1=NC=C(Br)C=C1

IUPAC: 5-bromo-2-[(4R)-4-(propan-2-yl)-4,5-dihydro-1,3-oxazol-2-yl]pyridine

InChI: InChI=1S/C11H13BrN2O/c1-7(2)10-6-15-11(14-10)9-4-3-8(12)5-13-9/h3-5,7,10H,6H2,1-2H3/t10-/m0/s1

Composition: C (49.09%), H (4.87%), Br (29.69%), N (10.41%), O (5.94%)

Molar Mass: 269.142

Atom Count: 28

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 1
Exact Mass 268.021126
Formal Charge 0
FSP3 0.45
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 0
InChIKey UIYNKZRZVDJOPI-JTQLQIEISA-N
Lipinski's Rule of Five 1
Molar Refractivity 61.85
Topological Polar Surface Area 34.48
Polarizability 23.97
Ring Count 2
Rotatable Bond Count 2

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