2-fluoro-1-(4-iodophenyl)ethanone

C8H6FIO — CID 87150711

IUPAC2-fluoro-1-(4-iodophenyl)ethanone
SMILESO=C(CF)c1ccc(I)cc1
InChIInChI=1S/C8H6FIO/c9-5-8(11)6-1-3-7(10)4-2-6/h1-4H,5H2
InChIKeyWXVCEUYBXWDBTK-UHFFFAOYSA-N
MW264.04 g/mol
LogP2.44
Rot. Bonds2

About 2-fluoro-1-(4-iodophenyl)ethanone

2-fluoro-1-(4-iodophenyl)ethanone (PubChem CID 87150711) has the molecular formula C8H6FIO and a molecular weight of 264.04 g/mol. Its IUPAC name is 2-fluoro-1-(4-iodophenyl)ethanone.

Molecular Properties

Compound Name2-fluoro-1-(4-iodophenyl)ethanone
PubChem CID87150711
Molecular FormulaC8H6FIO
Molecular Weight264.04 g/mol
Exact Mass263.94
IUPAC Name2-fluoro-1-(4-iodophenyl)ethanone
SMILESO=C(CF)c1ccc(I)cc1
InChIInChI=1S/C8H6FIO/c9-5-8(11)6-1-3-7(10)4-2-6/h1-4H,5H2
InChIKeyWXVCEUYBXWDBTK-UHFFFAOYSA-N
XLogP2.44
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.04
LogP ≤ 52.44
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

1,3-bis(4-iodophenyl)propane-1,3-dione
CID 15256965
1-[4-(2-fluoroacetyl)phenyl]-2-hydroxyethanone
CID 58149469
bis[4-(4-iodobenzoyl)phenyl]methanone
CID 22494471
1-(4-iodophenyl)-2-phenylethanone
CID 24723884
2-fluoro-1-(4-phenoxyphenyl)ethanone
CID 141218544
2-bromo-1-(4-iodophenyl)ethanone;1-(4-iodophenyl)ethanone
CID 159611000
7-chloro-1-(4-iodophenyl)heptan-1-one
CID 24723863
1-(4-iodophenyl)-3-phenylpropan-1-one
CID 43160297
6-chloro-1-(4-iodophenyl)hexan-1-one
CID 24723862
4-iodobenzoic acid;nickel
CID 54603201
2-(2-bromophenyl)-1-(4-iodophenyl)ethanone
CID 24723892
1-(4-iodophenyl)-2-(2-methylphenyl)ethanone
CID 43160312

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-1-(4-iodophenyl)ethanone?
The IUPAC name of 2-fluoro-1-(4-iodophenyl)ethanone (CID 87150711) is 2-fluoro-1-(4-iodophenyl)ethanone.
What is the SMILES notation for 2-fluoro-1-(4-iodophenyl)ethanone?
The canonical SMILES for 2-fluoro-1-(4-iodophenyl)ethanone is O=C(CF)c1ccc(I)cc1.
What is the InChIKey of 2-fluoro-1-(4-iodophenyl)ethanone?
The InChIKey is WXVCEUYBXWDBTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6FIO/c9-5-8(11)6-1-3-7(10)4-2-6/h1-4H,5H2.
What are the key properties of 2-fluoro-1-(4-iodophenyl)ethanone?
2-fluoro-1-(4-iodophenyl)ethanone has a molecular weight of 264.04 g/mol, XLogP of 2.44, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-1-(4-iodophenyl)ethanone is sourced from PubChem (CID 87150711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).