hydroxy-methoxy-phenyl-λ3-iodane

C7H9IO2 — CID 89044198

IUPAChydroxy-methoxy-phenyl-λ3-iodane
SMILESCOI(O)c1ccccc1
InChIInChI=1S/C7H9IO2/c1-10-8(9)7-5-3-2-4-6-7/h2-6,9H,1H3
InChIKeyFBBUGMWKBPJRCN-UHFFFAOYSA-N
MW252.05 g/mol
LogP1.83
Rot. Bonds2

About hydroxy-methoxy-phenyl-λ3-iodane

hydroxy-methoxy-phenyl-λ3-iodane (PubChem CID 89044198) has the molecular formula C7H9IO2 and a molecular weight of 252.05 g/mol. Its IUPAC name is hydroxy-methoxy-phenyl-λ3-iodane.

Molecular Properties

Compound Namehydroxy-methoxy-phenyl-λ3-iodane
PubChem CID89044198
Molecular FormulaC7H9IO2
Molecular Weight252.05 g/mol
Exact Mass251.96
IUPAC Namehydroxy-methoxy-phenyl-λ3-iodane
SMILESCOI(O)c1ccccc1
InChIInChI=1S/C7H9IO2/c1-10-8(9)7-5-3-2-4-6-7/h2-6,9H,1H3
InChIKeyFBBUGMWKBPJRCN-UHFFFAOYSA-N
XLogP1.83
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.05
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of hydroxy-methoxy-phenyl-λ3-iodane?
The IUPAC name of hydroxy-methoxy-phenyl-λ3-iodane (CID 89044198) is hydroxy-methoxy-phenyl-λ3-iodane.
What is the SMILES notation for hydroxy-methoxy-phenyl-λ3-iodane?
The canonical SMILES for hydroxy-methoxy-phenyl-λ3-iodane is COI(O)c1ccccc1.
What is the InChIKey of hydroxy-methoxy-phenyl-λ3-iodane?
The InChIKey is FBBUGMWKBPJRCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9IO2/c1-10-8(9)7-5-3-2-4-6-7/h2-6,9H,1H3.
What are the key properties of hydroxy-methoxy-phenyl-λ3-iodane?
hydroxy-methoxy-phenyl-λ3-iodane has a molecular weight of 252.05 g/mol, XLogP of 1.83, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for hydroxy-methoxy-phenyl-λ3-iodane is sourced from PubChem (CID 89044198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).