2-[(4-iodophenoxy)methyl]furan

C11H9IO2 — CID 60772612

IUPAC2-[(4-iodophenoxy)methyl]furan
SMILESIc1ccc(OCc2ccco2)cc1
InChIInChI=1S/C11H9IO2/c12-9-3-5-10(6-4-9)14-8-11-2-1-7-13-11/h1-7H,8H2
InChIKeyWUIYWCHQYMDDFQ-UHFFFAOYSA-N
MW300.10 g/mol
LogP3.46
Rot. Bonds3

About 2-[(4-iodophenoxy)methyl]furan

2-[(4-iodophenoxy)methyl]furan (PubChem CID 60772612) has the molecular formula C11H9IO2 and a molecular weight of 300.10 g/mol. Its IUPAC name is 2-[(4-iodophenoxy)methyl]furan.

Molecular Properties

Compound Name2-[(4-iodophenoxy)methyl]furan
PubChem CID60772612
Molecular FormulaC11H9IO2
Molecular Weight300.10 g/mol
Exact Mass299.96
IUPAC Name2-[(4-iodophenoxy)methyl]furan
SMILESIc1ccc(OCc2ccco2)cc1
InChIInChI=1S/C11H9IO2/c12-9-3-5-10(6-4-9)14-8-11-2-1-7-13-11/h1-7H,8H2
InChIKeyWUIYWCHQYMDDFQ-UHFFFAOYSA-N
XLogP3.46
TPSA22.37 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.10
LogP ≤ 53.46
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

2-[4-(furan-2-ylmethoxy)phenyl]ethanamine
CID 65362318
2-(furan-2-ylmethoxy)-5-iodopyrimidine
CID 116649117
2-(furan-3-yloxymethyl)furan
CID 54008523
4-(furan-2-ylmethoxy)-N'-hydroxybenzenecarboximidamide
CID 43188231
2-chloro-N'-[4-(furan-2-ylmethoxy)phenyl]ethanimidamide
CID 169368088
2-(furan-2-ylmethoxy)pyrimidine
CID 125483373
furan-2-ylmethoxysilane
CID 130768813
1-[5-(furan-2-ylmethoxy)-2-pyridinyl]ethanone
CID 83120059
(1R)-1-[5-(furan-2-ylmethoxy)-2-pyridinyl]ethanamine
CID 83128074
4-(furan-2-ylmethoxy)-1-methylpyrazole
CID 116794087
2-[[3-(trifluoromethyl)phenoxy]methyl]furan
CID 101055355
tris(furan-2-ylmethoxy) phosphite
CID 88505221

Frequently Asked Questions

What is the IUPAC name of 2-[(4-iodophenoxy)methyl]furan?
The IUPAC name of 2-[(4-iodophenoxy)methyl]furan (CID 60772612) is 2-[(4-iodophenoxy)methyl]furan.
What is the SMILES notation for 2-[(4-iodophenoxy)methyl]furan?
The canonical SMILES for 2-[(4-iodophenoxy)methyl]furan is Ic1ccc(OCc2ccco2)cc1.
What is the InChIKey of 2-[(4-iodophenoxy)methyl]furan?
The InChIKey is WUIYWCHQYMDDFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9IO2/c12-9-3-5-10(6-4-9)14-8-11-2-1-7-13-11/h1-7H,8H2.
What are the key properties of 2-[(4-iodophenoxy)methyl]furan?
2-[(4-iodophenoxy)methyl]furan has a molecular weight of 300.10 g/mol, XLogP of 3.46, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-iodophenoxy)methyl]furan is sourced from PubChem (CID 60772612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).