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4,6-dibromo-3-fluoro-2-methoxyaniline

4,6-dibromo-3-fluoro-2-methoxyaniline

CAS: 2682115-67-7

Formula: C7H6Br2FNO

SMILES: COC1=C(N)C(Br)=CC(Br)=C1F

IUPAC: 4,6-dibromo-3-fluoro-2-methoxyaniline

InChI: InChI=1S/C7H6Br2FNO/c1-12-7-5(10)3(8)2-4(9)6(7)11/h2H,11H2,1H3

Composition: C (28.13%), H (2.02%), Br (53.46%), F (6.36%), N (4.69%), O (5.35%)

Molar Mass: 298.937

Atom Count: 18

Heavy Atom Count: 12

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 296.880018
Formal Charge 0
FSP3 0.14
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey UZYZUPZOPLRFHD-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 52.68
Topological Polar Surface Area 35.25
Polarizability 19.86
Ring Count 1
Rotatable Bond Count 1

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