2-(2-methoxycarbonylphenyl)acetic acid

C10H10O4 — CID 584245

IUPAC2-(2-methoxycarbonylphenyl)acetic acid
SMILESCOC(=O)c1ccccc1CC(=O)O
InChIInChI=1S/C10H10O4/c1-14-10(13)8-5-3-2-4-7(8)6-9(11)12/h2-5H,6H2,1H3,(H,11,12)
InChIKeyUFUWTDVWSUXJEH-UHFFFAOYSA-N
MW194.19 g/mol
LogP1.10
Rot. Bonds3

About 2-(2-methoxycarbonylphenyl)acetic acid

2-(2-methoxycarbonylphenyl)acetic acid (PubChem CID 584245) has the molecular formula C10H10O4 and a molecular weight of 194.19 g/mol. Its IUPAC name is 2-(2-methoxycarbonylphenyl)acetic acid.

Molecular Properties

Compound Name2-(2-methoxycarbonylphenyl)acetic acid
PubChem CID584245
Molecular FormulaC10H10O4
Molecular Weight194.19 g/mol
Exact Mass194.06
IUPAC Name2-(2-methoxycarbonylphenyl)acetic acid
SMILESCOC(=O)c1ccccc1CC(=O)O
InChIInChI=1S/C10H10O4/c1-14-10(13)8-5-3-2-4-7(8)6-9(11)12/h2-5H,6H2,1H3,(H,11,12)
InChIKeyUFUWTDVWSUXJEH-UHFFFAOYSA-N
XLogP1.10
TPSA63.60 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.19
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxycarbonylphenyl)acetic acid?
The IUPAC name of 2-(2-methoxycarbonylphenyl)acetic acid (CID 584245) is 2-(2-methoxycarbonylphenyl)acetic acid.
What is the SMILES notation for 2-(2-methoxycarbonylphenyl)acetic acid?
The canonical SMILES for 2-(2-methoxycarbonylphenyl)acetic acid is COC(=O)c1ccccc1CC(=O)O.
What is the InChIKey of 2-(2-methoxycarbonylphenyl)acetic acid?
The InChIKey is UFUWTDVWSUXJEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10O4/c1-14-10(13)8-5-3-2-4-7(8)6-9(11)12/h2-5H,6H2,1H3,(H,11,12).
What are the key properties of 2-(2-methoxycarbonylphenyl)acetic acid?
2-(2-methoxycarbonylphenyl)acetic acid has a molecular weight of 194.19 g/mol, XLogP of 1.10, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxycarbonylphenyl)acetic acid is sourced from PubChem (CID 584245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).