2-[2-(4-fluorobenzoyl)phenyl]acetic acid

C15H11FO3 — CID 132556862

IUPAC2-[2-(4-fluorobenzoyl)phenyl]acetic acid
SMILESO=C(O)Cc1ccccc1C(=O)c1ccc(F)cc1
InChIInChI=1S/C15H11FO3/c16-12-7-5-10(6-8-12)15(19)13-4-2-1-3-11(13)9-14(17)18/h1-8H,9H2,(H,17,18)
InChIKeyMPUBTURUPVLTRE-UHFFFAOYSA-N
MW258.25 g/mol
LogP2.68
Rot. Bonds4

About 2-[2-(4-fluorobenzoyl)phenyl]acetic acid

2-[2-(4-fluorobenzoyl)phenyl]acetic acid (PubChem CID 132556862) has the molecular formula C15H11FO3 and a molecular weight of 258.25 g/mol. Its IUPAC name is 2-[2-(4-fluorobenzoyl)phenyl]acetic acid.

Molecular Properties

Compound Name2-[2-(4-fluorobenzoyl)phenyl]acetic acid
PubChem CID132556862
Molecular FormulaC15H11FO3
Molecular Weight258.25 g/mol
Exact Mass258.07
IUPAC Name2-[2-(4-fluorobenzoyl)phenyl]acetic acid
SMILESO=C(O)Cc1ccccc1C(=O)c1ccc(F)cc1
InChIInChI=1S/C15H11FO3/c16-12-7-5-10(6-8-12)15(19)13-4-2-1-3-11(13)9-14(17)18/h1-8H,9H2,(H,17,18)
InChIKeyMPUBTURUPVLTRE-UHFFFAOYSA-N
XLogP2.68
TPSA54.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.25
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[2-(4-methoxybenzoyl)phenyl]acetic acid
CID 15621221
(4-fluorophenyl)-phenylmethanone
CID 161464622
(2-benzylsulfanylphenyl)-(4-fluorophenyl)methanone
CID 151592012
[2-(4-fluorobenzoyl)phenyl]azanium
CID 101152012
2-(4-fluorobenzoyl)benzoate
CID 5082940
2-(2-benzoylphenyl)acetyl chloride
CID 139777615
2-benzofuran-1,3-dione;2-(4-fluorobenzoyl)benzoic acid;2-[2-[(4-fluorophenyl)methyl]phenyl]acetic acid;methane
CID 158530217
(2-benzoyl-4-fluorophenyl)-(4-fluorophenyl)methanone
CID 139633468
sodium;(2-ethylphenyl)-phenylmethanone;hydride
CID 175475173
sodium 2-[2-amino-3-(4-fluorobenzoyl)phenyl]acetate
CID 23684695
2-[4-(4-fluorobenzoyl)phenyl]-1-phenylethanone
CID 102580971
N',2-bis(4-fluorobenzoyl)benzohydrazide
CID 55554421

Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-fluorobenzoyl)phenyl]acetic acid?
The IUPAC name of 2-[2-(4-fluorobenzoyl)phenyl]acetic acid (CID 132556862) is 2-[2-(4-fluorobenzoyl)phenyl]acetic acid.
What is the SMILES notation for 2-[2-(4-fluorobenzoyl)phenyl]acetic acid?
The canonical SMILES for 2-[2-(4-fluorobenzoyl)phenyl]acetic acid is O=C(O)Cc1ccccc1C(=O)c1ccc(F)cc1.
What is the InChIKey of 2-[2-(4-fluorobenzoyl)phenyl]acetic acid?
The InChIKey is MPUBTURUPVLTRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11FO3/c16-12-7-5-10(6-8-12)15(19)13-4-2-1-3-11(13)9-14(17)18/h1-8H,9H2,(H,17,18).
What are the key properties of 2-[2-(4-fluorobenzoyl)phenyl]acetic acid?
2-[2-(4-fluorobenzoyl)phenyl]acetic acid has a molecular weight of 258.25 g/mol, XLogP of 2.68, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-fluorobenzoyl)phenyl]acetic acid is sourced from PubChem (CID 132556862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).