diiodovanadium;2-(methoxymethyl)oxirane

C4H8I2O2V — CID 158509470

IUPACdiiodovanadium;2-(methoxymethyl)oxirane
SMILESCOCC1CO1.I[V]I
InChIInChI=1S/C4H8O2.2HI.V/c1-5-2-4-3-6-4;;;/h4H,2-3H2,1H3;2*1H;/q;;;+2/p-2
InChIKeyHKWHVTINZHKCKD-UHFFFAOYSA-L
MW392.86 g/mol
LogP1.80
Rot. Bonds2

About diiodovanadium;2-(methoxymethyl)oxirane

diiodovanadium;2-(methoxymethyl)oxirane (PubChem CID 158509470) has the molecular formula C4H8I2O2V and a molecular weight of 392.86 g/mol. Its IUPAC name is diiodovanadium;2-(methoxymethyl)oxirane.

Molecular Properties

Compound Namediiodovanadium;2-(methoxymethyl)oxirane
PubChem CID158509470
Molecular FormulaC4H8I2O2V
Molecular Weight392.86 g/mol
Exact Mass392.81
IUPAC Namediiodovanadium;2-(methoxymethyl)oxirane
SMILESCOCC1CO1.I[V]I
InChIInChI=1S/C4H8O2.2HI.V/c1-5-2-4-3-6-4;;;/h4H,2-3H2,1H3;2*1H;/q;;;+2/p-2
InChIKeyHKWHVTINZHKCKD-UHFFFAOYSA-L
XLogP1.80
TPSA21.76 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.86
LogP ≤ 51.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of diiodovanadium;2-(methoxymethyl)oxirane?
The IUPAC name of diiodovanadium;2-(methoxymethyl)oxirane (CID 158509470) is diiodovanadium;2-(methoxymethyl)oxirane.
What is the SMILES notation for diiodovanadium;2-(methoxymethyl)oxirane?
The canonical SMILES for diiodovanadium;2-(methoxymethyl)oxirane is COCC1CO1.I[V]I.
What is the InChIKey of diiodovanadium;2-(methoxymethyl)oxirane?
The InChIKey is HKWHVTINZHKCKD-UHFFFAOYSA-L. The full InChI is InChI=1S/C4H8O2.2HI.V/c1-5-2-4-3-6-4;;;/h4H,2-3H2,1H3;2*1H;/q;;;+2/p-2.
What are the key properties of diiodovanadium;2-(methoxymethyl)oxirane?
diiodovanadium;2-(methoxymethyl)oxirane has a molecular weight of 392.86 g/mol, XLogP of 1.80, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for diiodovanadium;2-(methoxymethyl)oxirane is sourced from PubChem (CID 158509470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).