dicyclohexylphosphane;iodomercury

C12H23HgIP — CID 13153740

IUPACdicyclohexylphosphane;iodomercury
SMILESC1CCC(PC2CCCCC2)CC1.I[Hg]
InChIInChI=1S/C12H23P.Hg.HI/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;;/h11-13H,1-10H2;;1H/q;+1;/p-1
InChIKeyYPORTARVFZICPR-UHFFFAOYSA-M
MW525.78 g/mol
LogP5.21
Rot. Bonds2

About dicyclohexylphosphane;iodomercury

dicyclohexylphosphane;iodomercury (PubChem CID 13153740) has the molecular formula C12H23HgIP and a molecular weight of 525.78 g/mol. Its IUPAC name is dicyclohexylphosphane;iodomercury.

Molecular Properties

Compound Namedicyclohexylphosphane;iodomercury
PubChem CID13153740
Molecular FormulaC12H23HgIP
Molecular Weight525.78 g/mol
Exact Mass527.03
IUPAC Namedicyclohexylphosphane;iodomercury
SMILESC1CCC(PC2CCCCC2)CC1.I[Hg]
InChIInChI=1S/C12H23P.Hg.HI/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;;/h11-13H,1-10H2;;1H/q;+1;/p-1
InChIKeyYPORTARVFZICPR-UHFFFAOYSA-M
XLogP5.21
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500525.78
LogP ≤ 55.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of dicyclohexylphosphane;iodomercury?
The IUPAC name of dicyclohexylphosphane;iodomercury (CID 13153740) is dicyclohexylphosphane;iodomercury.
What is the SMILES notation for dicyclohexylphosphane;iodomercury?
The canonical SMILES for dicyclohexylphosphane;iodomercury is C1CCC(PC2CCCCC2)CC1.I[Hg].
What is the InChIKey of dicyclohexylphosphane;iodomercury?
The InChIKey is YPORTARVFZICPR-UHFFFAOYSA-M. The full InChI is InChI=1S/C12H23P.Hg.HI/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;;/h11-13H,1-10H2;;1H/q;+1;/p-1.
What are the key properties of dicyclohexylphosphane;iodomercury?
dicyclohexylphosphane;iodomercury has a molecular weight of 525.78 g/mol, XLogP of 5.21, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dicyclohexylphosphane;iodomercury is sourced from PubChem (CID 13153740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).