(2-fluorophenyl)-(4-hydroxy-3-iodophenyl)methanone

C13H8FIO2 — CID 11279298

IUPAC(2-fluorophenyl)-(4-hydroxy-3-iodophenyl)methanone
SMILESO=C(c1ccc(O)c(I)c1)c1ccccc1F
InChIInChI=1S/C13H8FIO2/c14-10-4-2-1-3-9(10)13(17)8-5-6-12(16)11(15)7-8/h1-7,16H
InChIKeyGIIMHUBJJSXQGT-UHFFFAOYSA-N
MW342.11 g/mol
LogP3.37
Rot. Bonds2

About (2-fluorophenyl)-(4-hydroxy-3-iodophenyl)methanone

(2-fluorophenyl)-(4-hydroxy-3-iodophenyl)methanone (PubChem CID 11279298) has the molecular formula C13H8FIO2 and a molecular weight of 342.11 g/mol. Its IUPAC name is (2-fluorophenyl)-(4-hydroxy-3-iodophenyl)methanone.

Molecular Properties

Compound Name(2-fluorophenyl)-(4-hydroxy-3-iodophenyl)methanone
PubChem CID11279298
Molecular FormulaC13H8FIO2
Molecular Weight342.11 g/mol
Exact Mass341.96
IUPAC Name(2-fluorophenyl)-(4-hydroxy-3-iodophenyl)methanone
SMILESO=C(c1ccc(O)c(I)c1)c1ccccc1F
InChIInChI=1S/C13H8FIO2/c14-10-4-2-1-3-9(10)13(17)8-5-6-12(16)11(15)7-8/h1-7,16H
InChIKeyGIIMHUBJJSXQGT-UHFFFAOYSA-N
XLogP3.37
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.11
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(2-fluorophenyl)-(3-iodophenyl)methanone
CID 24722822
(2-fluorophenyl)-(4-hydroxyphenyl)methanone
CID 2783235
(3-fluorophenyl)-(4-hydroxy-3-iodophenyl)methanone
CID 11325317
[2-(2-fluorobenzoyl)phenyl]-(2-fluorophenyl)methanone
CID 130332183
5-(2-fluorobenzoyl)-2,3-dihydroxybenzonitrile
CID 3079411
2,3-dihydro-1H-inden-5-yl-(2-fluorophenyl)methanone
CID 43338936
2,3-dihydro-1,4-benzodioxin-6-yl-(2-fluorophenyl)methanone
CID 766923
(2-fluorophenyl)-[4-(trifluoromethyl)phenyl]methanone
CID 57261811
(3,4-diethoxyphenyl)-(2-fluorophenyl)methanone
CID 43337653
(2-fluorophenyl)-quinolin-7-ylmethanone
CID 81220480
(2,3-dichloro-4-hydroxyphenyl)-(2-fluorophenyl)methanone
CID 13015711
(2-fluorophenyl)-(2,4,5-trifluorophenyl)methanone
CID 103301189

Frequently Asked Questions

What is the IUPAC name of (2-fluorophenyl)-(4-hydroxy-3-iodophenyl)methanone?
The IUPAC name of (2-fluorophenyl)-(4-hydroxy-3-iodophenyl)methanone (CID 11279298) is (2-fluorophenyl)-(4-hydroxy-3-iodophenyl)methanone.
What is the SMILES notation for (2-fluorophenyl)-(4-hydroxy-3-iodophenyl)methanone?
The canonical SMILES for (2-fluorophenyl)-(4-hydroxy-3-iodophenyl)methanone is O=C(c1ccc(O)c(I)c1)c1ccccc1F.
What is the InChIKey of (2-fluorophenyl)-(4-hydroxy-3-iodophenyl)methanone?
The InChIKey is GIIMHUBJJSXQGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8FIO2/c14-10-4-2-1-3-9(10)13(17)8-5-6-12(16)11(15)7-8/h1-7,16H.
What are the key properties of (2-fluorophenyl)-(4-hydroxy-3-iodophenyl)methanone?
(2-fluorophenyl)-(4-hydroxy-3-iodophenyl)methanone has a molecular weight of 342.11 g/mol, XLogP of 3.37, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-fluorophenyl)-(4-hydroxy-3-iodophenyl)methanone is sourced from PubChem (CID 11279298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).