(3-iodophenyl)methyl hypoiodite

C7H6I2O — CID 167240125

IUPAC(3-iodophenyl)methyl hypoiodite
SMILESIOCc1cccc(I)c1
InChIInChI=1S/C7H6I2O/c8-7-3-1-2-6(4-7)5-10-9/h1-4H,5H2
InChIKeyFWCRKEAPFZZODU-UHFFFAOYSA-N
MW359.93 g/mol
LogP3.16
Rot. Bonds2

About (3-iodophenyl)methyl hypoiodite

(3-iodophenyl)methyl hypoiodite (PubChem CID 167240125) has the molecular formula C7H6I2O and a molecular weight of 359.93 g/mol. Its IUPAC name is (3-iodophenyl)methyl hypoiodite.

Molecular Properties

Compound Name(3-iodophenyl)methyl hypoiodite
PubChem CID167240125
Molecular FormulaC7H6I2O
Molecular Weight359.93 g/mol
Exact Mass359.85
IUPAC Name(3-iodophenyl)methyl hypoiodite
SMILESIOCc1cccc(I)c1
InChIInChI=1S/C7H6I2O/c8-7-3-1-2-6(4-7)5-10-9/h1-4H,5H2
InChIKeyFWCRKEAPFZZODU-UHFFFAOYSA-N
XLogP3.16
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.93
LogP ≤ 53.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

O-[(3-iodophenyl)methyl]hydroxylamine
CID 25137641
1-iodo-3-[10-[(3-iodophenyl)methoxy]decoxymethyl]benzene
CID 101169604
1-iodo-3-[[3-[(3-iodophenyl)methoxy]-2,2-bis[(3-iodophenyl)methoxymethyl]propoxy]methyl]benzene
CID 101115926
1-iodo-3-(2-phenylethoxymethyl)benzene
CID 59371407
(3-iodophenyl)methyl hydrogen sulfite
CID 174745935
1-(chloromethyl)-3-iodobenzene
CID 13059978
tert-butyl-[(3-iodophenyl)methoxy]-dimethylsilane
CID 66845200
2-(3-iodophenyl)-1-methoxyethanol
CID 163737603
2-(3-iodophenyl)ethanol
CID 15169850
2-[(3-iodophenyl)methoxy]-1,3,2λ5,4-dioxadiphosphetan-4-ium 2,4-dioxide
CID 18547286
1-iodo-3-(2-methylpropyl)benzene
CID 18417600
2-(3-iodophenyl)acetonitrile
CID 2759368

Frequently Asked Questions

What is the IUPAC name of (3-iodophenyl)methyl hypoiodite?
The IUPAC name of (3-iodophenyl)methyl hypoiodite (CID 167240125) is (3-iodophenyl)methyl hypoiodite.
What is the SMILES notation for (3-iodophenyl)methyl hypoiodite?
The canonical SMILES for (3-iodophenyl)methyl hypoiodite is IOCc1cccc(I)c1.
What is the InChIKey of (3-iodophenyl)methyl hypoiodite?
The InChIKey is FWCRKEAPFZZODU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6I2O/c8-7-3-1-2-6(4-7)5-10-9/h1-4H,5H2.
What are the key properties of (3-iodophenyl)methyl hypoiodite?
(3-iodophenyl)methyl hypoiodite has a molecular weight of 359.93 g/mol, XLogP of 3.16, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3-iodophenyl)methyl hypoiodite is sourced from PubChem (CID 167240125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).