bromozinc(1+);ethenylbenzene

C8H7BrZn — CID 15977272

IUPACbromozinc(1+);ethenylbenzene
SMILES[H]/[C-]=C\c1ccccc1.[Zn+]Br
InChIInChI=1S/C8H7.BrH.Zn/c1-2-8-6-4-3-5-7-8;;/h1-7H;1H;/q-1;;+2/p-1
InChIKeyXTAPDCLUQXYAQC-UHFFFAOYSA-M
MW248.44 g/mol
LogP2.98
Rot. Bonds1

About bromozinc(1+);ethenylbenzene

bromozinc(1+);ethenylbenzene (PubChem CID 15977272) has the molecular formula C8H7BrZn and a molecular weight of 248.44 g/mol. Its IUPAC name is bromozinc(1+);ethenylbenzene.

Molecular Properties

Compound Namebromozinc(1+);ethenylbenzene
PubChem CID15977272
Molecular FormulaC8H7BrZn
Molecular Weight248.44 g/mol
Exact Mass245.90
IUPAC Namebromozinc(1+);ethenylbenzene
SMILES[H]/[C-]=C\c1ccccc1.[Zn+]Br
InChIInChI=1S/C8H7.BrH.Zn/c1-2-8-6-4-3-5-7-8;;/h1-7H;1H;/q-1;;+2/p-1
InChIKeyXTAPDCLUQXYAQC-UHFFFAOYSA-M
XLogP2.98
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.44
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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CID 134861199
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ethenylbenzene;nickel;bis(triphenylphosphanium)
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sodium;ethenylbenzene;2-methylprop-2-enoic acid
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CID 23281160
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CID 10864906
1-ethenyl-3-ethenylbenzene
CID 102253224
5,5-dibromo-6-[(E)-2-phenylethenyl]cyclohexa-1,3-diene
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CID 70567885
CID 70567885
CID 70569152
CID 70569152

Frequently Asked Questions

What is the IUPAC name of bromozinc(1+);ethenylbenzene?
The IUPAC name of bromozinc(1+);ethenylbenzene (CID 15977272) is bromozinc(1+);ethenylbenzene.
What is the SMILES notation for bromozinc(1+);ethenylbenzene?
The canonical SMILES for bromozinc(1+);ethenylbenzene is [H]/[C-]=C\c1ccccc1.[Zn+]Br.
What is the InChIKey of bromozinc(1+);ethenylbenzene?
The InChIKey is XTAPDCLUQXYAQC-UHFFFAOYSA-M. The full InChI is InChI=1S/C8H7.BrH.Zn/c1-2-8-6-4-3-5-7-8;;/h1-7H;1H;/q-1;;+2/p-1.
What are the key properties of bromozinc(1+);ethenylbenzene?
bromozinc(1+);ethenylbenzene has a molecular weight of 248.44 g/mol, XLogP of 2.98, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bromozinc(1+);ethenylbenzene is sourced from PubChem (CID 15977272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).