1-fluoro-3-(2-fluorophenyl)-2-iodobenzene

C12H7F2I — CID 46313915

IUPAC1-fluoro-3-(2-fluorophenyl)-2-iodobenzene
SMILESFc1ccccc1-c1cccc(F)c1I
InChIInChI=1S/C12H7F2I/c13-10-6-2-1-4-8(10)9-5-3-7-11(14)12(9)15/h1-7H
InChIKeyOJSDZUGYTCBMCV-UHFFFAOYSA-N
MW316.09 g/mol
LogP4.24
Rot. Bonds1

About 1-fluoro-3-(2-fluorophenyl)-2-iodobenzene

1-fluoro-3-(2-fluorophenyl)-2-iodobenzene (PubChem CID 46313915) has the molecular formula C12H7F2I and a molecular weight of 316.09 g/mol. Its IUPAC name is 1-fluoro-3-(2-fluorophenyl)-2-iodobenzene.

Molecular Properties

Compound Name1-fluoro-3-(2-fluorophenyl)-2-iodobenzene
PubChem CID46313915
Molecular FormulaC12H7F2I
Molecular Weight316.09 g/mol
Exact Mass315.96
IUPAC Name1-fluoro-3-(2-fluorophenyl)-2-iodobenzene
SMILESFc1ccccc1-c1cccc(F)c1I
InChIInChI=1S/C12H7F2I/c13-10-6-2-1-4-8(10)9-5-3-7-11(14)12(9)15/h1-7H
InChIKeyOJSDZUGYTCBMCV-UHFFFAOYSA-N
XLogP4.24
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.09
LogP ≤ 54.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

4-(3-fluoro-2-iodophenyl)pyridine
CID 46317259
1-fluoro-2,3-diiodobenzene
CID 10958978
2-(3-fluoro-2-iodophenyl)isoindole-1,3-dione
CID 114259645
1,2-difluoro-3-(2-fluorophenyl)benzene;methanol
CID 70977056
1,4-bis(2-fluorophenyl)benzene
CID 58121760
1-fluoro-3-(2-fluorophenyl)-2-(trifluoromethyl)benzene
CID 46314542
1-fluoro-3-(2-fluorophenyl)-2-phenylbenzene
CID 90908920
1-fluoro-2-[2-(2-phenylphenyl)phenyl]benzene
CID 141475621
1-bromo-2-[2-(2-fluorophenyl)phenyl]benzene
CID 168811602
1-fluoro-4-(2-fluorophenyl)-2-iodobenzene
CID 46313932
2-(3,4-difluoro-2-iodophenyl)phenol
CID 172627178
2-(2-fluorophenyl)-1,3-dimethylbenzene
CID 22075461

Frequently Asked Questions

What is the IUPAC name of 1-fluoro-3-(2-fluorophenyl)-2-iodobenzene?
The IUPAC name of 1-fluoro-3-(2-fluorophenyl)-2-iodobenzene (CID 46313915) is 1-fluoro-3-(2-fluorophenyl)-2-iodobenzene.
What is the SMILES notation for 1-fluoro-3-(2-fluorophenyl)-2-iodobenzene?
The canonical SMILES for 1-fluoro-3-(2-fluorophenyl)-2-iodobenzene is Fc1ccccc1-c1cccc(F)c1I.
What is the InChIKey of 1-fluoro-3-(2-fluorophenyl)-2-iodobenzene?
The InChIKey is OJSDZUGYTCBMCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7F2I/c13-10-6-2-1-4-8(10)9-5-3-7-11(14)12(9)15/h1-7H.
What are the key properties of 1-fluoro-3-(2-fluorophenyl)-2-iodobenzene?
1-fluoro-3-(2-fluorophenyl)-2-iodobenzene has a molecular weight of 316.09 g/mol, XLogP of 4.24, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-3-(2-fluorophenyl)-2-iodobenzene is sourced from PubChem (CID 46313915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).