(2R)-2-hydroxy-2-(4-methoxyphenyl)acetic acid

C9H10O4 — CID 6951708

IUPAC(2R)-2-hydroxy-2-(4-methoxyphenyl)acetic acid
SMILESCOc1ccc([C@@H](O)C(=O)O)cc1
InChIInChI=1S/C9H10O4/c1-13-7-4-2-6(3-5-7)8(10)9(11)12/h2-5,8,10H,1H3,(H,11,12)/t8-/m1/s1
InChIKeyITECRQOOEQWFPE-MRVPVSSYSA-N
MW182.17 g/mol
LogP0.81
Rot. Bonds3

About (2R)-2-hydroxy-2-(4-methoxyphenyl)acetic acid

(2R)-2-hydroxy-2-(4-methoxyphenyl)acetic acid (PubChem CID 6951708) has the molecular formula C9H10O4 and a molecular weight of 182.17 g/mol. Its IUPAC name is (2R)-2-hydroxy-2-(4-methoxyphenyl)acetic acid.

Molecular Properties

Compound Name(2R)-2-hydroxy-2-(4-methoxyphenyl)acetic acid
PubChem CID6951708
Molecular FormulaC9H10O4
Molecular Weight182.17 g/mol
Exact Mass182.06
IUPAC Name(2R)-2-hydroxy-2-(4-methoxyphenyl)acetic acid
SMILESCOc1ccc([C@@H](O)C(=O)O)cc1
InChIInChI=1S/C9H10O4/c1-13-7-4-2-6(3-5-7)8(10)9(11)12/h2-5,8,10H,1H3,(H,11,12)/t8-/m1/s1
InChIKeyITECRQOOEQWFPE-MRVPVSSYSA-N
XLogP0.81
TPSA66.76 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.17
LogP ≤ 50.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

ethane;2-hydroxy-2-(4-methoxyphenyl)acetic acid
CID 143238154
3-hydroxy-3-(4-methoxyphenyl)-2-oxopropanoic acid
CID 70435403
1-hydroxy-1-(4-methoxyphenyl)propan-2-one
CID 10080999
calcium bis(2-hydroxy-2-(4-methoxyphenyl)acetate)
CID 140565006
2-(3,5-dimethoxyphenyl)-2-hydroxyacetic acid
CID 22346233
(2S)-2-hydroxy-2-(4-methoxyphenyl)-N-methylacetamide
CID 92859938
propan-2-yl (2S)-2-hydroxy-2-(4-methoxyphenyl)acetate
CID 129353793
(2S,3R)-2-amino-3-hydroxy-3-(4-methoxyphenyl)propanoic acid
CID 10965805
(3R)-2-chloro-3-hydroxy-3-(4-methoxyphenyl)propanoic acid
CID 140981337
3-fluoro-2-(4-methoxyphenyl)propanoic acid
CID 20555403
3-(4-methoxyphenyl)-2-methylpropanoic acid
CID 10535804
2-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]-2-hydroxyacetic acid
CID 167729087

Frequently Asked Questions

What is the IUPAC name of (2R)-2-hydroxy-2-(4-methoxyphenyl)acetic acid?
The IUPAC name of (2R)-2-hydroxy-2-(4-methoxyphenyl)acetic acid (CID 6951708) is (2R)-2-hydroxy-2-(4-methoxyphenyl)acetic acid.
What is the SMILES notation for (2R)-2-hydroxy-2-(4-methoxyphenyl)acetic acid?
The canonical SMILES for (2R)-2-hydroxy-2-(4-methoxyphenyl)acetic acid is COc1ccc([C@@H](O)C(=O)O)cc1.
What is the InChIKey of (2R)-2-hydroxy-2-(4-methoxyphenyl)acetic acid?
The InChIKey is ITECRQOOEQWFPE-MRVPVSSYSA-N. The full InChI is InChI=1S/C9H10O4/c1-13-7-4-2-6(3-5-7)8(10)9(11)12/h2-5,8,10H,1H3,(H,11,12)/t8-/m1/s1.
What are the key properties of (2R)-2-hydroxy-2-(4-methoxyphenyl)acetic acid?
(2R)-2-hydroxy-2-(4-methoxyphenyl)acetic acid has a molecular weight of 182.17 g/mol, XLogP of 0.81, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-hydroxy-2-(4-methoxyphenyl)acetic acid is sourced from PubChem (CID 6951708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).