2-(2-hydroxy-5-methylphenyl)acetic acid

C9H10O3 — CID 13360645

IUPAC2-(2-hydroxy-5-methylphenyl)acetic acid
SMILESCc1ccc(O)c(CC(=O)O)c1
InChIInChI=1S/C9H10O3/c1-6-2-3-8(10)7(4-6)5-9(11)12/h2-4,10H,5H2,1H3,(H,11,12)
InChIKeyRDMFKTGZYKNWGQ-UHFFFAOYSA-N
MW166.18 g/mol
LogP1.33
Rot. Bonds2

About 2-(2-hydroxy-5-methylphenyl)acetic acid

2-(2-hydroxy-5-methylphenyl)acetic acid (PubChem CID 13360645) has the molecular formula C9H10O3 and a molecular weight of 166.18 g/mol. Its IUPAC name is 2-(2-hydroxy-5-methylphenyl)acetic acid.

Molecular Properties

Compound Name2-(2-hydroxy-5-methylphenyl)acetic acid
PubChem CID13360645
Molecular FormulaC9H10O3
Molecular Weight166.18 g/mol
Exact Mass166.06
IUPAC Name2-(2-hydroxy-5-methylphenyl)acetic acid
SMILESCc1ccc(O)c(CC(=O)O)c1
InChIInChI=1S/C9H10O3/c1-6-2-3-8(10)7(4-6)5-9(11)12/h2-4,10H,5H2,1H3,(H,11,12)
InChIKeyRDMFKTGZYKNWGQ-UHFFFAOYSA-N
XLogP1.33
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.18
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[2-(2-hydroxyphenyl)ethyl]-4-methylphenol
CID 154267038
3-(2-hydroxy-5-methylphenyl)-1-(4-methylphenyl)propan-1-one
CID 102344252
2-[N-[(2-hydroxy-5-methylphenyl)methyl]anilino]acetic acid
CID 65056920
2-[2-(iodomethyl)-5-methylphenyl]acetic acid
CID 91883927
2-(2-hydroxy-5-methylphenyl)acetaldehyde
CID 23471205
N-[(2-hydroxy-5-methylphenyl)methyl]-N-methylacetamide
CID 130034284
2-[2-hydroxy-5-[(3-methylphenyl)diazenyl]phenyl]acetic acid
CID 135843564
2-[(2-hydroxy-5-methylphenyl)methyl-methylamino]-2-methylpropanoic acid
CID 65061038
2-[(2-hydroxy-5-methylphenyl)methyl]-4-methylphenol;tetrachlorotungsten
CID 153466850
(E)-5-(2-hydroxy-5-methylphenyl)pent-3-en-2-one
CID 139494540
sodium;2-[2-[carboxymethyl-[(2-hydroxy-5-methylphenyl)methyl]amino]ethyl-(2-hydroxyethyl)amino]acetic acid;iron
CID 170846192
2-(2-azidoethyl)-4-methylphenol
CID 151587113

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxy-5-methylphenyl)acetic acid?
The IUPAC name of 2-(2-hydroxy-5-methylphenyl)acetic acid (CID 13360645) is 2-(2-hydroxy-5-methylphenyl)acetic acid.
What is the SMILES notation for 2-(2-hydroxy-5-methylphenyl)acetic acid?
The canonical SMILES for 2-(2-hydroxy-5-methylphenyl)acetic acid is Cc1ccc(O)c(CC(=O)O)c1.
What is the InChIKey of 2-(2-hydroxy-5-methylphenyl)acetic acid?
The InChIKey is RDMFKTGZYKNWGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10O3/c1-6-2-3-8(10)7(4-6)5-9(11)12/h2-4,10H,5H2,1H3,(H,11,12).
What are the key properties of 2-(2-hydroxy-5-methylphenyl)acetic acid?
2-(2-hydroxy-5-methylphenyl)acetic acid has a molecular weight of 166.18 g/mol, XLogP of 1.33, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxy-5-methylphenyl)acetic acid is sourced from PubChem (CID 13360645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).