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

C13H10F2O — CID 46312197

IUPAC1-fluoro-2-(2-fluorophenyl)-3-methoxybenzene
SMILESCOc1cccc(F)c1-c1ccccc1F
InChIInChI=1S/C13H10F2O/c1-16-12-8-4-7-11(15)13(12)9-5-2-3-6-10(9)14/h2-8H,1H3
InChIKeyPMGZAWJYTKFFEE-UHFFFAOYSA-N
MW220.22 g/mol
LogP3.64
Rot. Bonds2

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

1-fluoro-2-(2-fluorophenyl)-3-methoxybenzene (PubChem CID 46312197) has the molecular formula C13H10F2O and a molecular weight of 220.22 g/mol. Its IUPAC name is 1-fluoro-2-(2-fluorophenyl)-3-methoxybenzene.

Molecular Properties

Compound Name1-fluoro-2-(2-fluorophenyl)-3-methoxybenzene
PubChem CID46312197
Molecular FormulaC13H10F2O
Molecular Weight220.22 g/mol
Exact Mass220.07
IUPAC Name1-fluoro-2-(2-fluorophenyl)-3-methoxybenzene
SMILESCOc1cccc(F)c1-c1ccccc1F
InChIInChI=1S/C13H10F2O/c1-16-12-8-4-7-11(15)13(12)9-5-2-3-6-10(9)14/h2-8H,1H3
InChIKeyPMGZAWJYTKFFEE-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

Analyze 1-fluoro-2-(2-fluorophenyl)-3-methoxybenzene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(2-fluorophenyl)benzene-1,3-diol;2-(2-fluorophenyl)-1,3-dimethoxybenzene
CID 159382015
5-(2-fluoro-6-methoxyphenyl)-3-(2-fluorophenyl)-1H-pyrazole
CID 134329207
2-(2,6-dimethoxyphenyl)-6-fluoroaniline
CID 107602899
1,3-difluoro-2-(2-methoxyphenyl)benzene;isothiocyanic acid
CID 175606865
1,2-difluoro-3-(2-methoxyphenyl)benzene
CID 57230342
2,4-dichloro-1-(2-fluoro-6-methoxyphenyl)benzene
CID 69117451
2-(2-fluoro-6-methoxyphenyl)pyridine
CID 66942163
2-(2-fluorophenyl)-1,3-dimethylbenzene
CID 22075461
3-fluoro-1-(2-fluorophenyl)-4-methoxy-2-methylbenzene
CID 118149723
magnesium;1-fluoro-2-methoxybenzene;hydride
CID 174440812
7-(2-fluoro-6-methoxyphenyl)-1,3-benzoxazol-2-amine
CID 90645217
4-(2-fluorophenyl)-2,3,5-tris(2-methoxyphenyl)pyridine
CID 174290369

Frequently Asked Questions

What is the IUPAC name of 1-fluoro-2-(2-fluorophenyl)-3-methoxybenzene?
The IUPAC name of 1-fluoro-2-(2-fluorophenyl)-3-methoxybenzene (CID 46312197) is 1-fluoro-2-(2-fluorophenyl)-3-methoxybenzene.
What is the SMILES notation for 1-fluoro-2-(2-fluorophenyl)-3-methoxybenzene?
The canonical SMILES for 1-fluoro-2-(2-fluorophenyl)-3-methoxybenzene is COc1cccc(F)c1-c1ccccc1F.
What is the InChIKey of 1-fluoro-2-(2-fluorophenyl)-3-methoxybenzene?
The InChIKey is PMGZAWJYTKFFEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10F2O/c1-16-12-8-4-7-11(15)13(12)9-5-2-3-6-10(9)14/h2-8H,1H3.
What are the key properties of 1-fluoro-2-(2-fluorophenyl)-3-methoxybenzene?
1-fluoro-2-(2-fluorophenyl)-3-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 1-fluoro-2-(2-fluorophenyl)-3-methoxybenzene is sourced from PubChem (CID 46312197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).