chloromercury;cyclopenta-1,3-diene

C5H5ClHg- — CID 25036899

IUPACchloromercury;cyclopenta-1,3-diene
SMILESCl[Hg].c1cc[cH-]c1
InChIInChI=1S/C5H5.ClH.Hg/c1-2-4-5-3-1;;/h1-5H;1H;/q-1;;+1/p-1
InChIKeyFHUGLBGCXRGVMC-UHFFFAOYSA-M
MW301.14 g/mol
LogP2.09
Rot. Bonds

About chloromercury;cyclopenta-1,3-diene

chloromercury;cyclopenta-1,3-diene (PubChem CID 25036899) has the molecular formula C5H5ClHg- and a molecular weight of 301.14 g/mol. Its IUPAC name is chloromercury;cyclopenta-1,3-diene.

Molecular Properties

Compound Namechloromercury;cyclopenta-1,3-diene
PubChem CID25036899
Molecular FormulaC5H5ClHg-
Molecular Weight301.14 g/mol
Exact Mass301.98
IUPAC Namechloromercury;cyclopenta-1,3-diene
SMILESCl[Hg].c1cc[cH-]c1
InChIInChI=1S/C5H5.ClH.Hg/c1-2-4-5-3-1;;/h1-5H;1H;/q-1;;+1/p-1
InChIKeyFHUGLBGCXRGVMC-UHFFFAOYSA-M
XLogP2.09
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.14
LogP ≤ 52.09
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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Frequently Asked Questions

What is the IUPAC name of chloromercury;cyclopenta-1,3-diene?
The IUPAC name of chloromercury;cyclopenta-1,3-diene (CID 25036899) is chloromercury;cyclopenta-1,3-diene.
What is the SMILES notation for chloromercury;cyclopenta-1,3-diene?
The canonical SMILES for chloromercury;cyclopenta-1,3-diene is Cl[Hg].c1cc[cH-]c1.
What is the InChIKey of chloromercury;cyclopenta-1,3-diene?
The InChIKey is FHUGLBGCXRGVMC-UHFFFAOYSA-M. The full InChI is InChI=1S/C5H5.ClH.Hg/c1-2-4-5-3-1;;/h1-5H;1H;/q-1;;+1/p-1.
What are the key properties of chloromercury;cyclopenta-1,3-diene?
chloromercury;cyclopenta-1,3-diene has a molecular weight of 301.14 g/mol, XLogP of 2.09, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for chloromercury;cyclopenta-1,3-diene is sourced from PubChem (CID 25036899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).