molecular iodine;tetramethylphosphanium

C4H12I2P+ — CID 159115246

IUPACmolecular iodine;tetramethylphosphanium
SMILESC[P+](C)(C)C.II
InChIInChI=1S/C4H12P.I2/c1-5(2,3)4;1-2/h1-4H3;/q+1;
InChIKeyHEKVMRUCJUVTNV-UHFFFAOYSA-N
MW344.92 g/mol
LogP3.29
Rot. Bonds

About molecular iodine;tetramethylphosphanium

molecular iodine;tetramethylphosphanium (PubChem CID 159115246) has the molecular formula C4H12I2P+ and a molecular weight of 344.92 g/mol. Its IUPAC name is molecular iodine;tetramethylphosphanium.

Molecular Properties

Compound Namemolecular iodine;tetramethylphosphanium
PubChem CID159115246
Molecular FormulaC4H12I2P+
Molecular Weight344.92 g/mol
Exact Mass344.88
IUPAC Namemolecular iodine;tetramethylphosphanium
SMILESC[P+](C)(C)C.II
InChIInChI=1S/C4H12P.I2/c1-5(2,3)4;1-2/h1-4H3;/q+1;
InChIKeyHEKVMRUCJUVTNV-UHFFFAOYSA-N
XLogP3.29
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.92
LogP ≤ 53.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of molecular iodine;tetramethylphosphanium?
The IUPAC name of molecular iodine;tetramethylphosphanium (CID 159115246) is molecular iodine;tetramethylphosphanium.
What is the SMILES notation for molecular iodine;tetramethylphosphanium?
The canonical SMILES for molecular iodine;tetramethylphosphanium is C[P+](C)(C)C.II.
What is the InChIKey of molecular iodine;tetramethylphosphanium?
The InChIKey is HEKVMRUCJUVTNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H12P.I2/c1-5(2,3)4;1-2/h1-4H3;/q+1;.
What are the key properties of molecular iodine;tetramethylphosphanium?
molecular iodine;tetramethylphosphanium has a molecular weight of 344.92 g/mol, XLogP of 3.29, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for molecular iodine;tetramethylphosphanium is sourced from PubChem (CID 159115246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).