magnesium;trifluoromethylbenzene;iodide

C7H4F3IMg — CID 10935323

IUPACmagnesium;trifluoromethylbenzene;iodide
SMILESFC(F)(F)c1c[c-]ccc1.[I-].[Mg+2]
InChIInChI=1S/C7H4F3.HI.Mg/c8-7(9,10)6-4-2-1-3-5-6;;/h1-2,4-5H;1H;/q-1;;+2/p-1
InChIKeyIFBOESVWZDBJJG-UHFFFAOYSA-M
MW296.31 g/mol
LogP-0.87
Rot. Bonds

About magnesium;trifluoromethylbenzene;iodide

magnesium;trifluoromethylbenzene;iodide (PubChem CID 10935323) has the molecular formula C7H4F3IMg and a molecular weight of 296.31 g/mol. Its IUPAC name is magnesium;trifluoromethylbenzene;iodide.

Molecular Properties

Compound Namemagnesium;trifluoromethylbenzene;iodide
PubChem CID10935323
Molecular FormulaC7H4F3IMg
Molecular Weight296.31 g/mol
Exact Mass295.92
IUPAC Namemagnesium;trifluoromethylbenzene;iodide
SMILESFC(F)(F)c1c[c-]ccc1.[I-].[Mg+2]
InChIInChI=1S/C7H4F3.HI.Mg/c8-7(9,10)6-4-2-1-3-5-6;;/h1-2,4-5H;1H;/q-1;;+2/p-1
InChIKeyIFBOESVWZDBJJG-UHFFFAOYSA-M
XLogP-0.87
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.31
LogP ≤ 5-0.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of magnesium;trifluoromethylbenzene;iodide?
The IUPAC name of magnesium;trifluoromethylbenzene;iodide (CID 10935323) is magnesium;trifluoromethylbenzene;iodide.
What is the SMILES notation for magnesium;trifluoromethylbenzene;iodide?
The canonical SMILES for magnesium;trifluoromethylbenzene;iodide is FC(F)(F)c1c[c-]ccc1.[I-].[Mg+2].
What is the InChIKey of magnesium;trifluoromethylbenzene;iodide?
The InChIKey is IFBOESVWZDBJJG-UHFFFAOYSA-M. The full InChI is InChI=1S/C7H4F3.HI.Mg/c8-7(9,10)6-4-2-1-3-5-6;;/h1-2,4-5H;1H;/q-1;;+2/p-1.
What are the key properties of magnesium;trifluoromethylbenzene;iodide?
magnesium;trifluoromethylbenzene;iodide has a molecular weight of 296.31 g/mol, XLogP of -0.87, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;trifluoromethylbenzene;iodide is sourced from PubChem (CID 10935323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).