chloro-(4-hydroxyphenyl)mercury

C6H5ClHgO — CID 12164

IUPACchloro-(4-hydroxyphenyl)mercury
SMILESOc1ccc([Hg]Cl)cc1
InChIInChI=1S/C6H5O.ClH.Hg/c7-6-4-2-1-3-5-6;;/h2-5,7H;1H;/q;;+1/p-1
InChIKeyTWFQKNGANGSSRM-UHFFFAOYSA-M
MW329.15 g/mol
LogP1.25
Rot. Bonds1

About chloro-(4-hydroxyphenyl)mercury

chloro-(4-hydroxyphenyl)mercury (PubChem CID 12164) has the molecular formula C6H5ClHgO and a molecular weight of 329.15 g/mol. Its IUPAC name is chloro-(4-hydroxyphenyl)mercury.

Molecular Properties

Compound Namechloro-(4-hydroxyphenyl)mercury
PubChem CID12164
Molecular FormulaC6H5ClHgO
Molecular Weight329.15 g/mol
Exact Mass329.97
IUPAC Namechloro-(4-hydroxyphenyl)mercury
SMILESOc1ccc([Hg]Cl)cc1
InChIInChI=1S/C6H5O.ClH.Hg/c7-6-4-2-1-3-5-6;;/h2-5,7H;1H;/q;;+1/p-1
InChIKeyTWFQKNGANGSSRM-UHFFFAOYSA-M
XLogP1.25
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.15
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Hydroquinone
CID 785
Phenol
CID 996
Catechol
CID 289
Resorcinol
CID 5054
4-Chlorophenol
CID 4684
Phloroglucinol
CID 359
3-Chlorophenol
CID 7933
Phenolate Sodium
CID 4445035
Nitrophenols
CID 88473196
4-Iodophenol
CID 10894
4-Fluorophenol
CID 9732
2-Iodophenol
CID 10784

Frequently Asked Questions

What is the IUPAC name of chloro-(4-hydroxyphenyl)mercury?
The IUPAC name of chloro-(4-hydroxyphenyl)mercury (CID 12164) is chloro-(4-hydroxyphenyl)mercury.
What is the SMILES notation for chloro-(4-hydroxyphenyl)mercury?
The canonical SMILES for chloro-(4-hydroxyphenyl)mercury is Oc1ccc([Hg]Cl)cc1.
What is the InChIKey of chloro-(4-hydroxyphenyl)mercury?
The InChIKey is TWFQKNGANGSSRM-UHFFFAOYSA-M. The full InChI is InChI=1S/C6H5O.ClH.Hg/c7-6-4-2-1-3-5-6;;/h2-5,7H;1H;/q;;+1/p-1.
What are the key properties of chloro-(4-hydroxyphenyl)mercury?
chloro-(4-hydroxyphenyl)mercury has a molecular weight of 329.15 g/mol, XLogP of 1.25, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-(4-hydroxyphenyl)mercury is sourced from PubChem (CID 12164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).