5-tert-butyl-3-fluoro-2-iodofuran

C8H10FIO — CID 146377035

IUPAC5-tert-butyl-3-fluoro-2-iodofuran
SMILESCC(C)(C)c1cc(F)c(I)o1
InChIInChI=1S/C8H10FIO/c1-8(2,3)6-4-5(9)7(10)11-6/h4H,1-3H3
InChIKeyFUPJFAFWIMYLEH-UHFFFAOYSA-N
MW268.07 g/mol
LogP3.32
Rot. Bonds

About 5-tert-butyl-3-fluoro-2-iodofuran

5-tert-butyl-3-fluoro-2-iodofuran (PubChem CID 146377035) has the molecular formula C8H10FIO and a molecular weight of 268.07 g/mol. Its IUPAC name is 5-tert-butyl-3-fluoro-2-iodofuran.

Molecular Properties

Compound Name5-tert-butyl-3-fluoro-2-iodofuran
PubChem CID146377035
Molecular FormulaC8H10FIO
Molecular Weight268.07 g/mol
Exact Mass267.98
IUPAC Name5-tert-butyl-3-fluoro-2-iodofuran
SMILESCC(C)(C)c1cc(F)c(I)o1
InChIInChI=1S/C8H10FIO/c1-8(2,3)6-4-5(9)7(10)11-6/h4H,1-3H3
InChIKeyFUPJFAFWIMYLEH-UHFFFAOYSA-N
XLogP3.32
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.07
LogP ≤ 53.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-tert-butyl-3-fluoro-2-iodofuran?
The IUPAC name of 5-tert-butyl-3-fluoro-2-iodofuran (CID 146377035) is 5-tert-butyl-3-fluoro-2-iodofuran.
What is the SMILES notation for 5-tert-butyl-3-fluoro-2-iodofuran?
The canonical SMILES for 5-tert-butyl-3-fluoro-2-iodofuran is CC(C)(C)c1cc(F)c(I)o1.
What is the InChIKey of 5-tert-butyl-3-fluoro-2-iodofuran?
The InChIKey is FUPJFAFWIMYLEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10FIO/c1-8(2,3)6-4-5(9)7(10)11-6/h4H,1-3H3.
What are the key properties of 5-tert-butyl-3-fluoro-2-iodofuran?
5-tert-butyl-3-fluoro-2-iodofuran has a molecular weight of 268.07 g/mol, XLogP of 3.32, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-tert-butyl-3-fluoro-2-iodofuran is sourced from PubChem (CID 146377035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).