2-(4-hydroxyphenyl)acetic acid

C8H8O3 — CID 127

IUPAC2-(4-hydroxyphenyl)acetic acid
SMILESO=C(O)Cc1ccc(O)cc1
InChIInChI=1S/C8H8O3/c9-7-3-1-6(2-4-7)5-8(10)11/h1-4,9H,5H2,(H,10,11)
InChIKeyXQXPVVBIMDBYFF-UHFFFAOYSA-N
MW152.15 g/mol
LogP1.02
Rot. Bonds2

About 2-(4-hydroxyphenyl)acetic acid

2-(4-hydroxyphenyl)acetic acid (PubChem CID 127) has the molecular formula C8H8O3 and a molecular weight of 152.15 g/mol. Its IUPAC name is 2-(4-hydroxyphenyl)acetic acid.

Molecular Properties

Compound Name2-(4-hydroxyphenyl)acetic acid
PubChem CID127
Molecular FormulaC8H8O3
Molecular Weight152.15 g/mol
Exact Mass152.05
IUPAC Name2-(4-hydroxyphenyl)acetic acid
SMILESO=C(O)Cc1ccc(O)cc1
InChIInChI=1S/C8H8O3/c9-7-3-1-6(2-4-7)5-8(10)11/h1-4,9H,5H2,(H,10,11)
InChIKeyXQXPVVBIMDBYFF-UHFFFAOYSA-N
XLogP1.02
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.15
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-hydroxyphenyl)acetic acid?
The IUPAC name of 2-(4-hydroxyphenyl)acetic acid (CID 127) is 2-(4-hydroxyphenyl)acetic acid.
What is the SMILES notation for 2-(4-hydroxyphenyl)acetic acid?
The canonical SMILES for 2-(4-hydroxyphenyl)acetic acid is O=C(O)Cc1ccc(O)cc1.
What is the InChIKey of 2-(4-hydroxyphenyl)acetic acid?
The InChIKey is XQXPVVBIMDBYFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8O3/c9-7-3-1-6(2-4-7)5-8(10)11/h1-4,9H,5H2,(H,10,11).
What are the key properties of 2-(4-hydroxyphenyl)acetic acid?
2-(4-hydroxyphenyl)acetic acid has a molecular weight of 152.15 g/mol, XLogP of 1.02, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-hydroxyphenyl)acetic acid is sourced from PubChem (CID 127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).