2-(2-hydroxyphenyl)-2-methylbutanoic acid

C11H14O3 — CID 83830636

IUPAC2-(2-hydroxyphenyl)-2-methylbutanoic acid
SMILESCCC(C)(C(=O)O)c1ccccc1O
InChIInChI=1S/C11H14O3/c1-3-11(2,10(13)14)8-6-4-5-7-9(8)12/h4-7,12H,3H2,1-2H3,(H,13,14)
InChIKeyYVHJKYMLKIZUOE-UHFFFAOYSA-N
MW194.23 g/mol
LogP2.14
Rot. Bonds3

About 2-(2-hydroxyphenyl)-2-methylbutanoic acid

2-(2-hydroxyphenyl)-2-methylbutanoic acid (PubChem CID 83830636) has the molecular formula C11H14O3 and a molecular weight of 194.23 g/mol. Its IUPAC name is 2-(2-hydroxyphenyl)-2-methylbutanoic acid.

Molecular Properties

Compound Name2-(2-hydroxyphenyl)-2-methylbutanoic acid
PubChem CID83830636
Molecular FormulaC11H14O3
Molecular Weight194.23 g/mol
Exact Mass194.09
IUPAC Name2-(2-hydroxyphenyl)-2-methylbutanoic acid
SMILESCCC(C)(C(=O)O)c1ccccc1O
InChIInChI=1S/C11H14O3/c1-3-11(2,10(13)14)8-6-4-5-7-9(8)12/h4-7,12H,3H2,1-2H3,(H,13,14)
InChIKeyYVHJKYMLKIZUOE-UHFFFAOYSA-N
XLogP2.14
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-(2-hydroxyphenyl)-2-methylbutanoic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-methyl-2-[2-(2-methylphenyl)phenyl]butanoic acid
CID 175208086
3,3-difluoro-3-(2-hydroxyphenyl)-2,2-dimethylpropanoic acid
CID 105487577
2,2,3-trifluoro-3-(2-hydroxyphenyl)butanoic acid
CID 105493906
carbonic acid;2-(2-methylhexan-2-yl)phenol
CID 88685515
2,4-bis(2-hydroxyphenyl)-2,4-dimethylpentan-3-one
CID 141323363
2-butyl-2-(2-hydroxyphenyl)heptanoic acid
CID 87233562
2-methyl-2-phenylbutanethioic S-acid
CID 87854025
2-(4-amino-2-fluorophenyl)-2-methylbutanoic acid
CID 117047700
tetrakis(2-tert-butylphenol);phosphorous acid
CID 175312297
5-(2-carboxybutan-2-yl)thiophene-2-carboxylic acid
CID 18961734
2-methyl-2-[2-(trifluoromethyl)phenyl]butanamide
CID 68627712
2-(2-hydroxyphenyl)-2-propan-2-yloxypropanoic acid
CID 84725487

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxyphenyl)-2-methylbutanoic acid?
The IUPAC name of 2-(2-hydroxyphenyl)-2-methylbutanoic acid (CID 83830636) is 2-(2-hydroxyphenyl)-2-methylbutanoic acid.
What is the SMILES notation for 2-(2-hydroxyphenyl)-2-methylbutanoic acid?
The canonical SMILES for 2-(2-hydroxyphenyl)-2-methylbutanoic acid is CCC(C)(C(=O)O)c1ccccc1O.
What is the InChIKey of 2-(2-hydroxyphenyl)-2-methylbutanoic acid?
The InChIKey is YVHJKYMLKIZUOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14O3/c1-3-11(2,10(13)14)8-6-4-5-7-9(8)12/h4-7,12H,3H2,1-2H3,(H,13,14).
What are the key properties of 2-(2-hydroxyphenyl)-2-methylbutanoic acid?
2-(2-hydroxyphenyl)-2-methylbutanoic acid has a molecular weight of 194.23 g/mol, XLogP of 2.14, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxyphenyl)-2-methylbutanoic acid is sourced from PubChem (CID 83830636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).