benzoyloxy(chloro)mercury

C7H5ClHgO2 — CID 70255792

IUPACbenzoyloxy(chloro)mercury
SMILESO=C(O[Hg]Cl)c1ccccc1
InChIInChI=1S/C7H6O2.ClH.Hg/c8-7(9)6-4-2-1-3-5-6;;/h1-5H,(H,8,9);1H;/q;;+2/p-2
InChIKeyHCHJSNHHBFGNGS-UHFFFAOYSA-L
MW357.16 g/mol
LogP1.99
Rot. Bonds2

About benzoyloxy(chloro)mercury

benzoyloxy(chloro)mercury (PubChem CID 70255792) has the molecular formula C7H5ClHgO2 and a molecular weight of 357.16 g/mol. Its IUPAC name is benzoyloxy(chloro)mercury.

Molecular Properties

Compound Namebenzoyloxy(chloro)mercury
PubChem CID70255792
Molecular FormulaC7H5ClHgO2
Molecular Weight357.16 g/mol
Exact Mass357.97
IUPAC Namebenzoyloxy(chloro)mercury
SMILESO=C(O[Hg]Cl)c1ccccc1
InChIInChI=1S/C7H6O2.ClH.Hg/c8-7(9)6-4-2-1-3-5-6;;/h1-5H,(H,8,9);1H;/q;;+2/p-2
InChIKeyHCHJSNHHBFGNGS-UHFFFAOYSA-L
XLogP1.99
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.16
LogP ≤ 51.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

argon;benzoyl benzenecarboperoxoate
CID 161437596
CID 19766641
CID 19766641
benzoyl benzenecarboperoxoate;hydron
CID 20524010
benzoyl benzoate;benzoyl chloride
CID 157050310
benzoyl benzenecarboperoxoate;trioxirane
CID 174834892
CID 157228504
CID 157228504
azanium benzenecarboperoxoate
CID 141076857
methyl benzoate;hydrate
CID 141218240
dibenzoyloxyboranyl benzoate
CID 139803166
chloro acetate;chloro benzoate
CID 68991315
benzoyloxy-[(2-sulfanylphenyl)methyl]mercury
CID 141017456
2-benzoyloxy-2-chloroacetic acid
CID 173354746

Frequently Asked Questions

What is the IUPAC name of benzoyloxy(chloro)mercury?
The IUPAC name of benzoyloxy(chloro)mercury (CID 70255792) is benzoyloxy(chloro)mercury.
What is the SMILES notation for benzoyloxy(chloro)mercury?
The canonical SMILES for benzoyloxy(chloro)mercury is O=C(O[Hg]Cl)c1ccccc1.
What is the InChIKey of benzoyloxy(chloro)mercury?
The InChIKey is HCHJSNHHBFGNGS-UHFFFAOYSA-L. The full InChI is InChI=1S/C7H6O2.ClH.Hg/c8-7(9)6-4-2-1-3-5-6;;/h1-5H,(H,8,9);1H;/q;;+2/p-2.
What are the key properties of benzoyloxy(chloro)mercury?
benzoyloxy(chloro)mercury has a molecular weight of 357.16 g/mol, XLogP of 1.99, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for benzoyloxy(chloro)mercury is sourced from PubChem (CID 70255792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).