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4-bromo-2-(hydroxymethyl)-6-methoxyphenol

4-bromo-2-(hydroxymethyl)-6-methoxyphenol

CAS: 35090-64-3

Formula: C8H9BrO3

SMILES: COC1=C(O)C(CO)=CC(Br)=C1

IUPAC: 4-bromo-2-(hydroxymethyl)-6-methoxyphenol

InChI: InChI=1S/C8H9BrO3/c1-12-7-3-6(9)2-5(4-10)8(7)11/h2-3,10-11H,4H2,1H3

Composition: C (41.23%), H (3.89%), Br (34.28%), O (20.59%)

Molar Mass: 233.061

Atom Count: 21

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 231.973507
Formal Charge 0
FSP3 0.25
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey UBLQIISPEAEAIX-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 48.94
Topological Polar Surface Area 49.69
Polarizability 18.86
Ring Count 1
Rotatable Bond Count 2

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90% <6 Days 35090-64-3 $241.50-$5,879.95$241.50$258.75$289.80$886.65$1,599.65$5,879.95$10,873.25
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