4-iodophosphanyloxyphenol

C6H6IO2P — CID 171082360

IUPAC4-iodophosphanyloxyphenol
SMILESOc1ccc(OPI)cc1
InChIInChI=1S/C6H6IO2P/c7-10-9-6-3-1-5(8)2-4-6/h1-4,8,10H
InChIKeyQZKHMTGYPSKZJX-UHFFFAOYSA-N
MW267.99 g/mol
LogP2.71
Rot. Bonds2

About 4-iodophosphanyloxyphenol

4-iodophosphanyloxyphenol (PubChem CID 171082360) has the molecular formula C6H6IO2P and a molecular weight of 267.99 g/mol. Its IUPAC name is 4-iodophosphanyloxyphenol.

Molecular Properties

Compound Name4-iodophosphanyloxyphenol
PubChem CID171082360
Molecular FormulaC6H6IO2P
Molecular Weight267.99 g/mol
Exact Mass267.92
IUPAC Name4-iodophosphanyloxyphenol
SMILESOc1ccc(OPI)cc1
InChIInChI=1S/C6H6IO2P/c7-10-9-6-3-1-5(8)2-4-6/h1-4,8,10H
InChIKeyQZKHMTGYPSKZJX-UHFFFAOYSA-N
XLogP2.71
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.99
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-aminooxyphenol
CID 67279043
methane;4-methoxyphenol
CID 159494332
bis(4-(4-hydroxyphenoxy)phenol);hydrate
CID 67711282
bis(4-methoxyphenol);zirconium(2+);dichloride
CID 172849740
4-(4-iodophenoxy)phenol
CID 12940617
CID 162428523
CID 162428523
4-methoxyphenol;4-methylphenol
CID 158312507
ethane;4-(4-methoxyphenyl)phenol
CID 161219857
benzene-1,2-diol;4-methoxyphenol
CID 70292826
benzene-1,4-diol;hydron
CID 137356428
argon;benzene-1,4-diol
CID 71441175
CID 158795306
CID 158795306

Frequently Asked Questions

What is the IUPAC name of 4-iodophosphanyloxyphenol?
The IUPAC name of 4-iodophosphanyloxyphenol (CID 171082360) is 4-iodophosphanyloxyphenol.
What is the SMILES notation for 4-iodophosphanyloxyphenol?
The canonical SMILES for 4-iodophosphanyloxyphenol is Oc1ccc(OPI)cc1.
What is the InChIKey of 4-iodophosphanyloxyphenol?
The InChIKey is QZKHMTGYPSKZJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6IO2P/c7-10-9-6-3-1-5(8)2-4-6/h1-4,8,10H.
What are the key properties of 4-iodophosphanyloxyphenol?
4-iodophosphanyloxyphenol has a molecular weight of 267.99 g/mol, XLogP of 2.71, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-iodophosphanyloxyphenol is sourced from PubChem (CID 171082360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).