2-iodo-4-methoxyfuran

C5H5IO2 — CID 167240564

IUPAC2-iodo-4-methoxyfuran
SMILESCOc1coc(I)c1
InChIInChI=1S/C5H5IO2/c1-7-4-2-5(6)8-3-4/h2-3H,1H3
InChIKeyAIOAPLCCZRXOKJ-UHFFFAOYSA-N
MW224.00 g/mol
LogP1.89
Rot. Bonds1

About 2-iodo-4-methoxyfuran

2-iodo-4-methoxyfuran (PubChem CID 167240564) has the molecular formula C5H5IO2 and a molecular weight of 224.00 g/mol. Its IUPAC name is 2-iodo-4-methoxyfuran.

Molecular Properties

Compound Name2-iodo-4-methoxyfuran
PubChem CID167240564
Molecular FormulaC5H5IO2
Molecular Weight224.00 g/mol
Exact Mass223.93
IUPAC Name2-iodo-4-methoxyfuran
SMILESCOc1coc(I)c1
InChIInChI=1S/C5H5IO2/c1-7-4-2-5(6)8-3-4/h2-3H,1H3
InChIKeyAIOAPLCCZRXOKJ-UHFFFAOYSA-N
XLogP1.89
TPSA22.37 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.00
LogP ≤ 51.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-methoxyfuran-2-ol
CID 11332448
4-methoxyfuran-2-carbonyl chloride
CID 21185644
2-methyl-4-methylperoxyfuran
CID 21129926
phosphane;1,3,5-trimethoxybenzene
CID 175232895
2-iodo-4-(4-methoxyphenyl)-1,3-oxazole
CID 45139286
3-iodo-6,8-dimethoxychromen-4-one
CID 130131544
(3-iodo-6-methoxybiphenylen-2-yl)-trimethylsilane
CID 135016768
2-methoxy-4-(4-methoxyphenyl)-1,3-oxazole
CID 154293116
2-iodo-4-[2-(5-methylfuran-3-yl)ethyl]furan
CID 143593973
2-iodo-5-methoxyaniline
CID 11139508
3-iodo-5-methoxy-2-methylbenzenethiol
CID 171011526
5-(3,5-dimethoxyphenyl)-3-iodo-1,2,4-oxadiazole
CID 112572230

Frequently Asked Questions

What is the IUPAC name of 2-iodo-4-methoxyfuran?
The IUPAC name of 2-iodo-4-methoxyfuran (CID 167240564) is 2-iodo-4-methoxyfuran.
What is the SMILES notation for 2-iodo-4-methoxyfuran?
The canonical SMILES for 2-iodo-4-methoxyfuran is COc1coc(I)c1.
What is the InChIKey of 2-iodo-4-methoxyfuran?
The InChIKey is AIOAPLCCZRXOKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5IO2/c1-7-4-2-5(6)8-3-4/h2-3H,1H3.
What are the key properties of 2-iodo-4-methoxyfuran?
2-iodo-4-methoxyfuran has a molecular weight of 224.00 g/mol, XLogP of 1.89, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-iodo-4-methoxyfuran is sourced from PubChem (CID 167240564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).