magnesium;1,4-dichloro-2-fluorobenzene-6-ide;bromide

C6H2BrCl2FMg — CID 133143364

IUPACmagnesium;1,4-dichloro-2-fluorobenzene-6-ide;bromide
SMILESFc1cc(Cl)c[c-]c1Cl.[Br-].[Mg+2]
InChIInChI=1S/C6H2Cl2F.BrH.Mg/c7-4-1-2-5(8)6(9)3-4;;/h1,3H;1H;/q-1;;+2/p-1
InChIKeyGHMNNHOHUNJUAN-UHFFFAOYSA-M
MW268.19 g/mol
LogP-0.44
Rot. Bonds

About magnesium;1,4-dichloro-2-fluorobenzene-6-ide;bromide

magnesium;1,4-dichloro-2-fluorobenzene-6-ide;bromide (PubChem CID 133143364) has the molecular formula C6H2BrCl2FMg and a molecular weight of 268.19 g/mol. Its IUPAC name is magnesium;1,4-dichloro-2-fluorobenzene-6-ide;bromide.

Molecular Properties

Compound Namemagnesium;1,4-dichloro-2-fluorobenzene-6-ide;bromide
PubChem CID133143364
Molecular FormulaC6H2BrCl2FMg
Molecular Weight268.19 g/mol
Exact Mass265.86
IUPAC Namemagnesium;1,4-dichloro-2-fluorobenzene-6-ide;bromide
SMILESFc1cc(Cl)c[c-]c1Cl.[Br-].[Mg+2]
InChIInChI=1S/C6H2Cl2F.BrH.Mg/c7-4-1-2-5(8)6(9)3-4;;/h1,3H;1H;/q-1;;+2/p-1
InChIKeyGHMNNHOHUNJUAN-UHFFFAOYSA-M
XLogP-0.44
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.19
LogP ≤ 5-0.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of magnesium;1,4-dichloro-2-fluorobenzene-6-ide;bromide?
The IUPAC name of magnesium;1,4-dichloro-2-fluorobenzene-6-ide;bromide (CID 133143364) is magnesium;1,4-dichloro-2-fluorobenzene-6-ide;bromide.
What is the SMILES notation for magnesium;1,4-dichloro-2-fluorobenzene-6-ide;bromide?
The canonical SMILES for magnesium;1,4-dichloro-2-fluorobenzene-6-ide;bromide is Fc1cc(Cl)c[c-]c1Cl.[Br-].[Mg+2].
What is the InChIKey of magnesium;1,4-dichloro-2-fluorobenzene-6-ide;bromide?
The InChIKey is GHMNNHOHUNJUAN-UHFFFAOYSA-M. The full InChI is InChI=1S/C6H2Cl2F.BrH.Mg/c7-4-1-2-5(8)6(9)3-4;;/h1,3H;1H;/q-1;;+2/p-1.
What are the key properties of magnesium;1,4-dichloro-2-fluorobenzene-6-ide;bromide?
magnesium;1,4-dichloro-2-fluorobenzene-6-ide;bromide has a molecular weight of 268.19 g/mol, XLogP of -0.44, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;1,4-dichloro-2-fluorobenzene-6-ide;bromide is sourced from PubChem (CID 133143364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).