(4-hydroxyphenyl)mercury(1+) chloride

C6H5ClHgO — CID 76968666

IUPAC(4-hydroxyphenyl)mercury(1+) chloride
SMILESOc1ccc([Hg+])cc1.[Cl-]
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
LogP-2.43
Rot. Bonds

About (4-hydroxyphenyl)mercury(1+) chloride

(4-hydroxyphenyl)mercury(1+) chloride (PubChem CID 76968666) has the molecular formula C6H5ClHgO and a molecular weight of 329.15 g/mol. Its IUPAC name is (4-hydroxyphenyl)mercury(1+) chloride.

Molecular Properties

Compound Name(4-hydroxyphenyl)mercury(1+) chloride
PubChem CID76968666
Molecular FormulaC6H5ClHgO
Molecular Weight329.15 g/mol
Exact Mass329.97
IUPAC Name(4-hydroxyphenyl)mercury(1+) chloride
SMILESOc1ccc([Hg+])cc1.[Cl-]
InChIInChI=1S/C6H5O.ClH.Hg/c7-6-4-2-1-3-5-6;;/h2-5,7H;1H;/q;;+1/p-1
InChIKeyTWFQKNGANGSSRM-UHFFFAOYSA-M
XLogP-2.43
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.15
LogP ≤ 5-2.43
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

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phenol;tantalum
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Frequently Asked Questions

What is the IUPAC name of (4-hydroxyphenyl)mercury(1+) chloride?
The IUPAC name of (4-hydroxyphenyl)mercury(1+) chloride (CID 76968666) is (4-hydroxyphenyl)mercury(1+) chloride.
What is the SMILES notation for (4-hydroxyphenyl)mercury(1+) chloride?
The canonical SMILES for (4-hydroxyphenyl)mercury(1+) chloride is Oc1ccc([Hg+])cc1.[Cl-].
What is the InChIKey of (4-hydroxyphenyl)mercury(1+) chloride?
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 (4-hydroxyphenyl)mercury(1+) chloride?
(4-hydroxyphenyl)mercury(1+) chloride has a molecular weight of 329.15 g/mol, XLogP of -2.43, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-hydroxyphenyl)mercury(1+) chloride is sourced from PubChem (CID 76968666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).