2-fluoro-4-(2-fluorophenyl)-1-methoxybenzene

C13H10F2O — CID 46312218

IUPAC2-fluoro-4-(2-fluorophenyl)-1-methoxybenzene
SMILESCOc1ccc(-c2ccccc2F)cc1F
InChIInChI=1S/C13H10F2O/c1-16-13-7-6-9(8-12(13)15)10-4-2-3-5-11(10)14/h2-8H,1H3
InChIKeyCCUOHSAPVAVMJZ-UHFFFAOYSA-N
MW220.22 g/mol
LogP3.64
Rot. Bonds2

About 2-fluoro-4-(2-fluorophenyl)-1-methoxybenzene

2-fluoro-4-(2-fluorophenyl)-1-methoxybenzene (PubChem CID 46312218) has the molecular formula C13H10F2O and a molecular weight of 220.22 g/mol. Its IUPAC name is 2-fluoro-4-(2-fluorophenyl)-1-methoxybenzene.

Molecular Properties

Compound Name2-fluoro-4-(2-fluorophenyl)-1-methoxybenzene
PubChem CID46312218
Molecular FormulaC13H10F2O
Molecular Weight220.22 g/mol
Exact Mass220.07
IUPAC Name2-fluoro-4-(2-fluorophenyl)-1-methoxybenzene
SMILESCOc1ccc(-c2ccccc2F)cc1F
InChIInChI=1S/C13H10F2O/c1-16-13-7-6-9(8-12(13)15)10-4-2-3-5-11(10)14/h2-8H,1H3
InChIKeyCCUOHSAPVAVMJZ-UHFFFAOYSA-N
XLogP3.64
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.22
LogP ≤ 53.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-4-(2-fluorophenyl)-1-methoxybenzene?
The IUPAC name of 2-fluoro-4-(2-fluorophenyl)-1-methoxybenzene (CID 46312218) is 2-fluoro-4-(2-fluorophenyl)-1-methoxybenzene.
What is the SMILES notation for 2-fluoro-4-(2-fluorophenyl)-1-methoxybenzene?
The canonical SMILES for 2-fluoro-4-(2-fluorophenyl)-1-methoxybenzene is COc1ccc(-c2ccccc2F)cc1F.
What is the InChIKey of 2-fluoro-4-(2-fluorophenyl)-1-methoxybenzene?
The InChIKey is CCUOHSAPVAVMJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10F2O/c1-16-13-7-6-9(8-12(13)15)10-4-2-3-5-11(10)14/h2-8H,1H3.
What are the key properties of 2-fluoro-4-(2-fluorophenyl)-1-methoxybenzene?
2-fluoro-4-(2-fluorophenyl)-1-methoxybenzene has a molecular weight of 220.22 g/mol, XLogP of 3.64, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-4-(2-fluorophenyl)-1-methoxybenzene is sourced from PubChem (CID 46312218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).