2-[2-(3-methoxyphenyl)phenyl]acetic acid

C15H14O3 — CID 2759556

IUPAC2-[2-(3-methoxyphenyl)phenyl]acetic acid
SMILESCOc1cccc(-c2ccccc2CC(=O)O)c1
InChIInChI=1S/C15H14O3/c1-18-13-7-4-6-11(9-13)14-8-3-2-5-12(14)10-15(16)17/h2-9H,10H2,1H3,(H,16,17)
InChIKeyBWFLKFVOJFTSQU-UHFFFAOYSA-N
MW242.27 g/mol
LogP2.99
Rot. Bonds4

About 2-[2-(3-methoxyphenyl)phenyl]acetic acid

2-[2-(3-methoxyphenyl)phenyl]acetic acid (PubChem CID 2759556) has the molecular formula C15H14O3 and a molecular weight of 242.27 g/mol. Its IUPAC name is 2-[2-(3-methoxyphenyl)phenyl]acetic acid.

Molecular Properties

Compound Name2-[2-(3-methoxyphenyl)phenyl]acetic acid
PubChem CID2759556
Molecular FormulaC15H14O3
Molecular Weight242.27 g/mol
Exact Mass242.09
IUPAC Name2-[2-(3-methoxyphenyl)phenyl]acetic acid
SMILESCOc1cccc(-c2ccccc2CC(=O)O)c1
InChIInChI=1S/C15H14O3/c1-18-13-7-4-6-11(9-13)14-8-3-2-5-12(14)10-15(16)17/h2-9H,10H2,1H3,(H,16,17)
InChIKeyBWFLKFVOJFTSQU-UHFFFAOYSA-N
XLogP2.99
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.27
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(3-methoxyphenyl)phenyl]acetic acid?
The IUPAC name of 2-[2-(3-methoxyphenyl)phenyl]acetic acid (CID 2759556) is 2-[2-(3-methoxyphenyl)phenyl]acetic acid.
What is the SMILES notation for 2-[2-(3-methoxyphenyl)phenyl]acetic acid?
The canonical SMILES for 2-[2-(3-methoxyphenyl)phenyl]acetic acid is COc1cccc(-c2ccccc2CC(=O)O)c1.
What is the InChIKey of 2-[2-(3-methoxyphenyl)phenyl]acetic acid?
The InChIKey is BWFLKFVOJFTSQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14O3/c1-18-13-7-4-6-11(9-13)14-8-3-2-5-12(14)10-15(16)17/h2-9H,10H2,1H3,(H,16,17).
What are the key properties of 2-[2-(3-methoxyphenyl)phenyl]acetic acid?
2-[2-(3-methoxyphenyl)phenyl]acetic acid has a molecular weight of 242.27 g/mol, XLogP of 2.99, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(3-methoxyphenyl)phenyl]acetic acid is sourced from PubChem (CID 2759556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).