[chloro(cyano)methyl]mercury

C2HClHgN — CID 141110141

IUPAC[chloro(cyano)methyl]mercury
SMILESN#CC(Cl)[Hg]
InChIInChI=1S/C2HClN.Hg/c3-1-2-4;/h1H;
InChIKeyBGOOJPVUDGLVAK-UHFFFAOYSA-N
MW275.08 g/mol
LogP0.62
Rot. Bonds

About [chloro(cyano)methyl]mercury

[chloro(cyano)methyl]mercury (PubChem CID 141110141) has the molecular formula C2HClHgN and a molecular weight of 275.08 g/mol. Its IUPAC name is [chloro(cyano)methyl]mercury.

Molecular Properties

Compound Name[chloro(cyano)methyl]mercury
PubChem CID141110141
Molecular FormulaC2HClHgN
Molecular Weight275.08 g/mol
Exact Mass275.95
IUPAC Name[chloro(cyano)methyl]mercury
SMILESN#CC(Cl)[Hg]
InChIInChI=1S/C2HClN.Hg/c3-1-2-4;/h1H;
InChIKeyBGOOJPVUDGLVAK-UHFFFAOYSA-N
XLogP0.62
TPSA23.79 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.08
LogP ≤ 50.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [chloro(cyano)methyl]mercury?
The IUPAC name of [chloro(cyano)methyl]mercury (CID 141110141) is [chloro(cyano)methyl]mercury.
What is the SMILES notation for [chloro(cyano)methyl]mercury?
The canonical SMILES for [chloro(cyano)methyl]mercury is N#CC(Cl)[Hg].
What is the InChIKey of [chloro(cyano)methyl]mercury?
The InChIKey is BGOOJPVUDGLVAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C2HClN.Hg/c3-1-2-4;/h1H;.
What are the key properties of [chloro(cyano)methyl]mercury?
[chloro(cyano)methyl]mercury has a molecular weight of 275.08 g/mol, XLogP of 0.62, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [chloro(cyano)methyl]mercury is sourced from PubChem (CID 141110141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).