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2-bromo-3-methoxypyridine

2-bromo-3-methoxypyridine

CAS: 24100-18-3

Formula: C6H6BrNO

SMILES: COC1=CC=CN=C1Br

IUPAC: 2-bromo-3-methoxypyridine

InChI: InChI=1S/C6H6BrNO/c1-9-5-3-2-4-8-6(5)7/h2-4H,1H3

Composition: C (38.33%), H (3.22%), Br (42.50%), N (7.45%), O (8.51%)

Molar Mass: 188.024

Atom Count: 15

Heavy Atom Count: 9

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 186.963277
Formal Charge 0
FSP3 0.17
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey PDOWLYNSFYZIQX-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 38.83
Topological Polar Surface Area 22.12
Polarizability 14.91
Ring Count 1
Rotatable Bond Count 1

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