aniline;mercury(2+)

C6H7HgN+2 — CID 23616182

IUPACaniline;mercury(2+)
SMILESNc1ccccc1.[Hg+2]
InChIInChI=1S/C6H7N.Hg/c7-6-4-2-1-3-5-6;/h1-5H,7H2;/q;+2
InChIKeyXRTYEZXMBOQKBD-UHFFFAOYSA-N
MW293.72 g/mol
LogP1.27
Rot. Bonds

About aniline;mercury(2+)

aniline;mercury(2+) (PubChem CID 23616182) has the molecular formula C6H7HgN+2 and a molecular weight of 293.72 g/mol. Its IUPAC name is aniline;mercury(2+).

Molecular Properties

Compound Nameaniline;mercury(2+)
PubChem CID23616182
Molecular FormulaC6H7HgN+2
Molecular Weight293.72 g/mol
Exact Mass295.03
IUPAC Nameaniline;mercury(2+)
SMILESNc1ccccc1.[Hg+2]
InChIInChI=1S/C6H7N.Hg/c7-6-4-2-1-3-5-6;/h1-5H,7H2;/q;+2
InChIKeyXRTYEZXMBOQKBD-UHFFFAOYSA-N
XLogP1.27
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.72
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

aniline;mercury
CID 54604260
aniline;azane
CID 171780637
aniline;niobium
CID 161015220
aniline;carbanide;hafnium
CID 158735732
aniline;pentakis(oxygen(2-));bis(vanadium)
CID 173287766
zinc;aniline;dichloride
CID 70636252
aniline;sulfane;hydrofluoride
CID 174744569
magnesium;aniline;carbanide
CID 87207909
CID 158400952
CID 158400952
sodium;aniline;hydride;dihydrate
CID 173275717
aniline;methanol
CID 140536335
aniline;cyclobutane
CID 174919664

Frequently Asked Questions

What is the IUPAC name of aniline;mercury(2+)?
The IUPAC name of aniline;mercury(2+) (CID 23616182) is aniline;mercury(2+).
What is the SMILES notation for aniline;mercury(2+)?
The canonical SMILES for aniline;mercury(2+) is Nc1ccccc1.[Hg+2].
What is the InChIKey of aniline;mercury(2+)?
The InChIKey is XRTYEZXMBOQKBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7N.Hg/c7-6-4-2-1-3-5-6;/h1-5H,7H2;/q;+2.
What are the key properties of aniline;mercury(2+)?
aniline;mercury(2+) has a molecular weight of 293.72 g/mol, XLogP of 1.27, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for aniline;mercury(2+) is sourced from PubChem (CID 23616182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).