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5-bromo-2-methoxy-4-methylpyridine

5-bromo-2-methoxy-4-methylpyridine

CAS: 164513-39-7

Formula: C7H8BrNO

SMILES: COC1=NC=C(Br)C(C)=C1

IUPAC: 5-bromo-2-methoxy-4-methylpyridine

InChI: InChI=1S/C7H8BrNO/c1-5-3-7(10-2)9-4-6(5)8/h3-4H,1-2H3

Composition: C (41.61%), H (3.99%), Br (39.55%), N (6.93%), O (7.92%)

Molar Mass: 202.051

Atom Count: 18

Heavy Atom Count: 10

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 200.978927
Formal Charge 0
FSP3 0.29
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey HTBPXLJKMNBQMS-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 43.34
Topological Polar Surface Area 22.12
Polarizability 16.59
Ring Count 1
Rotatable Bond Count 1

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