magnesium;1H-inden-1-ide;bromide

C9H7BrMg — CID 12823996

IUPACmagnesium;1H-inden-1-ide;bromide
SMILES[Br-].[Mg+2].c1ccc2[cH-]ccc2c1
InChIInChI=1S/C9H7.BrH.Mg/c1-2-5-9-7-3-6-8(9)4-1;;/h1-7H;1H;/q-1;;+2/p-1
InChIKeyYKQZWFBYAPYVHB-UHFFFAOYSA-M
MW219.36 g/mol
LogP-0.82
Rot. Bonds

About magnesium;1H-inden-1-ide;bromide

magnesium;1H-inden-1-ide;bromide (PubChem CID 12823996) has the molecular formula C9H7BrMg and a molecular weight of 219.36 g/mol. Its IUPAC name is magnesium;1H-inden-1-ide;bromide.

Molecular Properties

Compound Namemagnesium;1H-inden-1-ide;bromide
PubChem CID12823996
Molecular FormulaC9H7BrMg
Molecular Weight219.36 g/mol
Exact Mass217.96
IUPAC Namemagnesium;1H-inden-1-ide;bromide
SMILES[Br-].[Mg+2].c1ccc2[cH-]ccc2c1
InChIInChI=1S/C9H7.BrH.Mg/c1-2-5-9-7-3-6-8(9)4-1;;/h1-7H;1H;/q-1;;+2/p-1
InChIKeyYKQZWFBYAPYVHB-UHFFFAOYSA-M
XLogP-0.82
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.36
LogP ≤ 5-0.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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cyclopenta-1,3-diene;1H-inden-1-ide;zirconium(4+)
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Frequently Asked Questions

What is the IUPAC name of magnesium;1H-inden-1-ide;bromide?
The IUPAC name of magnesium;1H-inden-1-ide;bromide (CID 12823996) is magnesium;1H-inden-1-ide;bromide.
What is the SMILES notation for magnesium;1H-inden-1-ide;bromide?
The canonical SMILES for magnesium;1H-inden-1-ide;bromide is [Br-].[Mg+2].c1ccc2[cH-]ccc2c1.
What is the InChIKey of magnesium;1H-inden-1-ide;bromide?
The InChIKey is YKQZWFBYAPYVHB-UHFFFAOYSA-M. The full InChI is InChI=1S/C9H7.BrH.Mg/c1-2-5-9-7-3-6-8(9)4-1;;/h1-7H;1H;/q-1;;+2/p-1.
What are the key properties of magnesium;1H-inden-1-ide;bromide?
magnesium;1H-inden-1-ide;bromide has a molecular weight of 219.36 g/mol, XLogP of -0.82, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;1H-inden-1-ide;bromide is sourced from PubChem (CID 12823996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).