2-hydroxy-2-(2-phenoxyphenyl)propanoic acid

C15H14O4 — CID 174597683

IUPAC2-hydroxy-2-(2-phenoxyphenyl)propanoic acid
SMILESCC(O)(C(=O)O)c1ccccc1Oc1ccccc1
InChIInChI=1S/C15H14O4/c1-15(18,14(16)17)12-9-5-6-10-13(12)19-11-7-3-2-4-8-11/h2-10,18H,1H3,(H,16,17)
InChIKeyPRRQCZPVQKAGMI-UHFFFAOYSA-N
MW258.27 g/mol
LogP2.77
Rot. Bonds4

About 2-hydroxy-2-(2-phenoxyphenyl)propanoic acid

2-hydroxy-2-(2-phenoxyphenyl)propanoic acid (PubChem CID 174597683) has the molecular formula C15H14O4 and a molecular weight of 258.27 g/mol. Its IUPAC name is 2-hydroxy-2-(2-phenoxyphenyl)propanoic acid.

Molecular Properties

Compound Name2-hydroxy-2-(2-phenoxyphenyl)propanoic acid
PubChem CID174597683
Molecular FormulaC15H14O4
Molecular Weight258.27 g/mol
Exact Mass258.09
IUPAC Name2-hydroxy-2-(2-phenoxyphenyl)propanoic acid
SMILESCC(O)(C(=O)O)c1ccccc1Oc1ccccc1
InChIInChI=1S/C15H14O4/c1-15(18,14(16)17)12-9-5-6-10-13(12)19-11-7-3-2-4-8-11/h2-10,18H,1H3,(H,16,17)
InChIKeyPRRQCZPVQKAGMI-UHFFFAOYSA-N
XLogP2.77
TPSA66.76 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.27
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-phenoxy-2-[2-(2-phenoxyphenyl)propan-2-yl]benzene
CID 19890139
(2S)-2-(2-fluorophenyl)-2-hydroxypropanoic acid
CID 55255014
phenoxybenzene;propane-2,2-diol
CID 174556232
(3R)-3-hydroxy-3-(2-methoxyphenyl)butan-2-one
CID 102236965
methyl 4-(2-tert-butylphenoxy)benzoate
CID 91084435
2-hydroxy-2-methylpropanoic acid;2-hydroxy-2-phenylpropanoic acid
CID 70572731
(2R)-2-hydroxy-2-phenylpropanoic acid
CID 736858
2,4-bis(2-methoxy-6-phenoxyphenyl)-2,4-dimethylpentan-3-one
CID 58608948
2-(2-phenoxyphenoxy)but-2-enoic acid
CID 70607804
bis[4-(2-phenoxyphenoxy)phenyl]methanone
CID 19849453
benzoic acid;2-phenoxybenzoic acid
CID 160712085
2-bromo-4-(2-tert-butylphenoxy)benzoic acid
CID 107282419

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-2-(2-phenoxyphenyl)propanoic acid?
The IUPAC name of 2-hydroxy-2-(2-phenoxyphenyl)propanoic acid (CID 174597683) is 2-hydroxy-2-(2-phenoxyphenyl)propanoic acid.
What is the SMILES notation for 2-hydroxy-2-(2-phenoxyphenyl)propanoic acid?
The canonical SMILES for 2-hydroxy-2-(2-phenoxyphenyl)propanoic acid is CC(O)(C(=O)O)c1ccccc1Oc1ccccc1.
What is the InChIKey of 2-hydroxy-2-(2-phenoxyphenyl)propanoic acid?
The InChIKey is PRRQCZPVQKAGMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14O4/c1-15(18,14(16)17)12-9-5-6-10-13(12)19-11-7-3-2-4-8-11/h2-10,18H,1H3,(H,16,17).
What are the key properties of 2-hydroxy-2-(2-phenoxyphenyl)propanoic acid?
2-hydroxy-2-(2-phenoxyphenyl)propanoic acid has a molecular weight of 258.27 g/mol, XLogP of 2.77, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-2-(2-phenoxyphenyl)propanoic acid is sourced from PubChem (CID 174597683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).