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4-bromo-1-fluoro-2-methylbenzene

4-bromo-1-fluoro-2-methylbenzene

CAS: 51437-00-4

Formula: C7H6BrF

SMILES: CC1=CC(Br)=CC=C1F

IUPAC: 4-bromo-1-fluoro-2-methylbenzene

InChI: InChI=1S/C7H6BrF/c1-5-4-6(8)2-3-7(5)9/h2-4H,1H3

Composition: C (44.48%), H (3.20%), Br (42.27%), F (10.05%)

Molar Mass: 189.027

Atom Count: 15

Heavy Atom Count: 9

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 187.963691
Formal Charge 0
FSP3 0.14
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 0
Hydrogen Bond Donor Count 0
InChIKey VXKYOKPNAXNAFU-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 38.94
Topological Polar Surface Area 0
Polarizability 14.67
Ring Count 1
Rotatable Bond Count 0

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Purity LeadTime CAS UnitPrice
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