2-hydroxypropanoic acid;mercury

C3H6HgO3 — CID 88512020

IUPAC2-hydroxypropanoic acid;mercury
SMILESCC(O)C(=O)O.[Hg]
InChIInChI=1S/C3H6O3.Hg/c1-2(4)3(5)6;/h2,4H,1H3,(H,5,6);
InChIKeyZNQPQJBWQGULNQ-UHFFFAOYSA-N
MW290.67 g/mol
LogP-0.55
Rot. Bonds1

About 2-hydroxypropanoic acid;mercury

2-hydroxypropanoic acid;mercury (PubChem CID 88512020) has the molecular formula C3H6HgO3 and a molecular weight of 290.67 g/mol. Its IUPAC name is 2-hydroxypropanoic acid;mercury.

Molecular Properties

Compound Name2-hydroxypropanoic acid;mercury
PubChem CID88512020
Molecular FormulaC3H6HgO3
Molecular Weight290.67 g/mol
Exact Mass292.00
IUPAC Name2-hydroxypropanoic acid;mercury
SMILESCC(O)C(=O)O.[Hg]
InChIInChI=1S/C3H6O3.Hg/c1-2(4)3(5)6;/h2,4H,1H3,(H,5,6);
InChIKeyZNQPQJBWQGULNQ-UHFFFAOYSA-N
XLogP-0.55
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.67
LogP ≤ 5-0.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxypropanoic acid;mercury?
The IUPAC name of 2-hydroxypropanoic acid;mercury (CID 88512020) is 2-hydroxypropanoic acid;mercury.
What is the SMILES notation for 2-hydroxypropanoic acid;mercury?
The canonical SMILES for 2-hydroxypropanoic acid;mercury is CC(O)C(=O)O.[Hg].
What is the InChIKey of 2-hydroxypropanoic acid;mercury?
The InChIKey is ZNQPQJBWQGULNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6O3.Hg/c1-2(4)3(5)6;/h2,4H,1H3,(H,5,6);.
What are the key properties of 2-hydroxypropanoic acid;mercury?
2-hydroxypropanoic acid;mercury has a molecular weight of 290.67 g/mol, XLogP of -0.55, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxypropanoic acid;mercury is sourced from PubChem (CID 88512020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).