2-fluoro-6-[(4-fluorophenyl)methoxy]benzoic acid

C14H10F2O3 — CID 104651324

IUPAC2-fluoro-6-[(4-fluorophenyl)methoxy]benzoic acid
SMILESO=C(O)c1c(F)cccc1OCc1ccc(F)cc1
InChIInChI=1S/C14H10F2O3/c15-10-6-4-9(5-7-10)8-19-12-3-1-2-11(16)13(12)14(17)18/h1-7H,8H2,(H,17,18)
InChIKeyDFCVRZISZOBLDI-UHFFFAOYSA-N
MW264.23 g/mol
LogP3.24
Rot. Bonds4

About 2-fluoro-6-[(4-fluorophenyl)methoxy]benzoic acid

2-fluoro-6-[(4-fluorophenyl)methoxy]benzoic acid (PubChem CID 104651324) has the molecular formula C14H10F2O3 and a molecular weight of 264.23 g/mol. Its IUPAC name is 2-fluoro-6-[(4-fluorophenyl)methoxy]benzoic acid.

Molecular Properties

Compound Name2-fluoro-6-[(4-fluorophenyl)methoxy]benzoic acid
PubChem CID104651324
Molecular FormulaC14H10F2O3
Molecular Weight264.23 g/mol
Exact Mass264.06
IUPAC Name2-fluoro-6-[(4-fluorophenyl)methoxy]benzoic acid
SMILESO=C(O)c1c(F)cccc1OCc1ccc(F)cc1
InChIInChI=1S/C14H10F2O3/c15-10-6-4-9(5-7-10)8-19-12-3-1-2-11(16)13(12)14(17)18/h1-7H,8H2,(H,17,18)
InChIKeyDFCVRZISZOBLDI-UHFFFAOYSA-N
XLogP3.24
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.23
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(2-chloro-3-fluorophenyl)methoxy]-6-fluorobenzoic acid
CID 104651365
2-fluoro-6-[(5-fluoro-2-methylphenyl)methoxy]benzoic acid
CID 107013949
2-fluoro-6-[(2,4,6-trimethylphenyl)methoxy]benzoic acid
CID 107014119
2-fluoro-6-(2-hydroxy-2-methylpropoxy)benzoic acid
CID 107014003
ethane;2-fluoro-6-propoxybenzoic acid
CID 142472968
2-fluoro-6-(1,2,4-oxadiazol-5-ylmethoxy)benzoic acid
CID 107013857
2-but-3-enoxy-6-fluorobenzoic acid
CID 79511653
2-bromo-6-fluoro-3-phenylmethoxybenzoic acid
CID 155293763
2-fluoro-6-(2-methylsulfanylethoxy)benzoic acid
CID 107013890
2-fluoro-6-hydroxybenzoic acid;2-fluoro-6-hydroxy-N-methoxy-N-methylbenzamide;2-fluoro-N-methoxy-6-[(4-methoxyphenyl)methoxy]-N-methylbenzamide
CID 160686333
2-amino-6-[(4-chloro-3-fluorophenyl)methoxy]benzoic acid
CID 107882860
2-fluoro-6-[(2-methyl-1,3-thiazol-4-yl)methoxy]benzoic acid
CID 104651304

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-6-[(4-fluorophenyl)methoxy]benzoic acid?
The IUPAC name of 2-fluoro-6-[(4-fluorophenyl)methoxy]benzoic acid (CID 104651324) is 2-fluoro-6-[(4-fluorophenyl)methoxy]benzoic acid.
What is the SMILES notation for 2-fluoro-6-[(4-fluorophenyl)methoxy]benzoic acid?
The canonical SMILES for 2-fluoro-6-[(4-fluorophenyl)methoxy]benzoic acid is O=C(O)c1c(F)cccc1OCc1ccc(F)cc1.
What is the InChIKey of 2-fluoro-6-[(4-fluorophenyl)methoxy]benzoic acid?
The InChIKey is DFCVRZISZOBLDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10F2O3/c15-10-6-4-9(5-7-10)8-19-12-3-1-2-11(16)13(12)14(17)18/h1-7H,8H2,(H,17,18).
What are the key properties of 2-fluoro-6-[(4-fluorophenyl)methoxy]benzoic acid?
2-fluoro-6-[(4-fluorophenyl)methoxy]benzoic acid has a molecular weight of 264.23 g/mol, XLogP of 3.24, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-6-[(4-fluorophenyl)methoxy]benzoic acid is sourced from PubChem (CID 104651324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).