magnesium;2,3,4,5,6,7,8-heptafluoro-1H-naphthalen-1-ide;bromide

C10BrF7Mg — CID 87467832

IUPACmagnesium;2,3,4,5,6,7,8-heptafluoro-1H-naphthalen-1-ide;bromide
SMILESFc1[c-]c2c(F)c(F)c(F)c(F)c2c(F)c1F.[Br-].[Mg+2]
InChIInChI=1S/C10F7.BrH.Mg/c11-3-1-2-4(7(14)6(3)13)8(15)10(17)9(16)5(2)12;;/h;1H;/q-1;;+2/p-1
InChIKeyWZYWXFNEGAREOF-UHFFFAOYSA-M
MW357.31 g/mol
LogP0.24
Rot. Bonds

About magnesium;2,3,4,5,6,7,8-heptafluoro-1H-naphthalen-1-ide;bromide

magnesium;2,3,4,5,6,7,8-heptafluoro-1H-naphthalen-1-ide;bromide (PubChem CID 87467832) has the molecular formula C10BrF7Mg and a molecular weight of 357.31 g/mol. Its IUPAC name is magnesium;2,3,4,5,6,7,8-heptafluoro-1H-naphthalen-1-ide;bromide.

Molecular Properties

Compound Namemagnesium;2,3,4,5,6,7,8-heptafluoro-1H-naphthalen-1-ide;bromide
PubChem CID87467832
Molecular FormulaC10BrF7Mg
Molecular Weight357.31 g/mol
Exact Mass355.89
IUPAC Namemagnesium;2,3,4,5,6,7,8-heptafluoro-1H-naphthalen-1-ide;bromide
SMILESFc1[c-]c2c(F)c(F)c(F)c(F)c2c(F)c1F.[Br-].[Mg+2]
InChIInChI=1S/C10F7.BrH.Mg/c11-3-1-2-4(7(14)6(3)13)8(15)10(17)9(16)5(2)12;;/h;1H;/q-1;;+2/p-1
InChIKeyWZYWXFNEGAREOF-UHFFFAOYSA-M
XLogP0.24
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.31
LogP ≤ 50.24
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'}, {'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of magnesium;2,3,4,5,6,7,8-heptafluoro-1H-naphthalen-1-ide;bromide?
The IUPAC name of magnesium;2,3,4,5,6,7,8-heptafluoro-1H-naphthalen-1-ide;bromide (CID 87467832) is magnesium;2,3,4,5,6,7,8-heptafluoro-1H-naphthalen-1-ide;bromide.
What is the SMILES notation for magnesium;2,3,4,5,6,7,8-heptafluoro-1H-naphthalen-1-ide;bromide?
The canonical SMILES for magnesium;2,3,4,5,6,7,8-heptafluoro-1H-naphthalen-1-ide;bromide is Fc1[c-]c2c(F)c(F)c(F)c(F)c2c(F)c1F.[Br-].[Mg+2].
What is the InChIKey of magnesium;2,3,4,5,6,7,8-heptafluoro-1H-naphthalen-1-ide;bromide?
The InChIKey is WZYWXFNEGAREOF-UHFFFAOYSA-M. The full InChI is InChI=1S/C10F7.BrH.Mg/c11-3-1-2-4(7(14)6(3)13)8(15)10(17)9(16)5(2)12;;/h;1H;/q-1;;+2/p-1.
What are the key properties of magnesium;2,3,4,5,6,7,8-heptafluoro-1H-naphthalen-1-ide;bromide?
magnesium;2,3,4,5,6,7,8-heptafluoro-1H-naphthalen-1-ide;bromide has a molecular weight of 357.31 g/mol, XLogP of 0.24, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;2,3,4,5,6,7,8-heptafluoro-1H-naphthalen-1-ide;bromide is sourced from PubChem (CID 87467832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).