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3-bromo-2-fluoro-6-methoxyaniline

3-bromo-2-fluoro-6-methoxyaniline

CAS: 1519458-46-8

Formula: C7H7BrFNO

SMILES: COC1=CC=C(Br)C(F)=C1N

IUPAC: 3-bromo-2-fluoro-6-methoxyaniline

InChI: InChI=1S/C7H7BrFNO/c1-11-5-3-2-4(8)6(9)7(5)10/h2-3H,10H2,1H3

Composition: C (38.21%), H (3.21%), Br (36.31%), F (8.63%), N (6.37%), O (7.27%)

Molar Mass: 220.041

Atom Count: 18

Heavy Atom Count: 11

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 218.969505
Formal Charge 0
FSP3 0.14
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey DYYFJEFOAVDMJB-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 45.06
Topological Polar Surface Area 35.25
Polarizability 16.7
Ring Count 1
Rotatable Bond Count 1

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