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

C13H8FIO — CID 24722824

IUPAC(4-fluorophenyl)-(3-iodophenyl)methanone
SMILESO=C(c1ccc(F)cc1)c1cccc(I)c1
InChIInChI=1S/C13H8FIO/c14-11-6-4-9(5-7-11)13(16)10-2-1-3-12(15)8-10/h1-8H
InChIKeyORZADNMJQJUFBJ-UHFFFAOYSA-N
MW326.11 g/mol
LogP3.66
Rot. Bonds2

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

(4-fluorophenyl)-(3-iodophenyl)methanone (PubChem CID 24722824) has the molecular formula C13H8FIO and a molecular weight of 326.11 g/mol. Its IUPAC name is (4-fluorophenyl)-(3-iodophenyl)methanone.

Molecular Properties

Compound Name(4-fluorophenyl)-(3-iodophenyl)methanone
PubChem CID24722824
Molecular FormulaC13H8FIO
Molecular Weight326.11 g/mol
Exact Mass325.96
IUPAC Name(4-fluorophenyl)-(3-iodophenyl)methanone
SMILESO=C(c1ccc(F)cc1)c1cccc(I)c1
InChIInChI=1S/C13H8FIO/c14-11-6-4-9(5-7-11)13(16)10-2-1-3-12(15)8-10/h1-8H
InChIKeyORZADNMJQJUFBJ-UHFFFAOYSA-N
XLogP3.66
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.11
LogP ≤ 53.66
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

[3-[3-(4-fluorobenzoyl)phenyl]phenyl]-(4-fluorophenyl)methanone
CID 71341049
(2,5-difluorophenyl)-(3-iodophenyl)methanone
CID 43159823
(3-chloro-4-fluorophenyl)-(3-iodophenyl)methanone
CID 24723076
(4-fluorophenyl)-phenylmethanone
CID 161464622
2-(4-fluorophenyl)-1-(3-iodophenyl)ethanone
CID 24723952
1-(3-iodophenyl)-2-[4-[2-(3-iodophenyl)-2-oxoacetyl]phenyl]ethane-1,2-dione
CID 2850310
(2-fluorophenyl)-(3-iodophenyl)methanone
CID 24722822
(2,3-difluorophenyl)-(3-iodophenyl)methanone
CID 114973513
2-[3-(4-fluorobenzoyl)phenyl]prop-2-enamide
CID 174372485
(4-fluorophenyl)-[3-(2-phenylethynyl)phenyl]methanone
CID 68993545
(4-fluorophenyl)-[4-[2-[4-(4-iodobenzoyl)phenyl]ethynyl]phenyl]methanone
CID 70875973
(4-fluorophenyl)-(3-propa-1,2-dienylphenyl)methanone
CID 150735803

Frequently Asked Questions

What is the IUPAC name of (4-fluorophenyl)-(3-iodophenyl)methanone?
The IUPAC name of (4-fluorophenyl)-(3-iodophenyl)methanone (CID 24722824) is (4-fluorophenyl)-(3-iodophenyl)methanone.
What is the SMILES notation for (4-fluorophenyl)-(3-iodophenyl)methanone?
The canonical SMILES for (4-fluorophenyl)-(3-iodophenyl)methanone is O=C(c1ccc(F)cc1)c1cccc(I)c1.
What is the InChIKey of (4-fluorophenyl)-(3-iodophenyl)methanone?
The InChIKey is ORZADNMJQJUFBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8FIO/c14-11-6-4-9(5-7-11)13(16)10-2-1-3-12(15)8-10/h1-8H.
What are the key properties of (4-fluorophenyl)-(3-iodophenyl)methanone?
(4-fluorophenyl)-(3-iodophenyl)methanone has a molecular weight of 326.11 g/mol, XLogP of 3.66, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-fluorophenyl)-(3-iodophenyl)methanone is sourced from PubChem (CID 24722824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).