(2R)-2-hydroxy-2-[4-(2-methoxyethoxy)phenyl]propanoic acid

C12H16O5 — CID 70114787

IUPAC(2R)-2-hydroxy-2-[4-(2-methoxyethoxy)phenyl]propanoic acid
SMILESCOCCOc1ccc([C@@](C)(O)C(=O)O)cc1
InChIInChI=1S/C12H16O5/c1-12(15,11(13)14)9-3-5-10(6-4-9)17-8-7-16-2/h3-6,15H,7-8H2,1-2H3,(H,13,14)/t12-/m1/s1
InChIKeyABEVOGWDHHHUJS-GFCCVEGCSA-N
MW240.25 g/mol
LogP1.00
Rot. Bonds6

About (2R)-2-hydroxy-2-[4-(2-methoxyethoxy)phenyl]propanoic acid

(2R)-2-hydroxy-2-[4-(2-methoxyethoxy)phenyl]propanoic acid (PubChem CID 70114787) has the molecular formula C12H16O5 and a molecular weight of 240.25 g/mol. Its IUPAC name is (2R)-2-hydroxy-2-[4-(2-methoxyethoxy)phenyl]propanoic acid.

Molecular Properties

Compound Name(2R)-2-hydroxy-2-[4-(2-methoxyethoxy)phenyl]propanoic acid
PubChem CID70114787
Molecular FormulaC12H16O5
Molecular Weight240.25 g/mol
Exact Mass240.10
IUPAC Name(2R)-2-hydroxy-2-[4-(2-methoxyethoxy)phenyl]propanoic acid
SMILESCOCCOc1ccc([C@@](C)(O)C(=O)O)cc1
InChIInChI=1S/C12H16O5/c1-12(15,11(13)14)9-3-5-10(6-4-9)17-8-7-16-2/h3-6,15H,7-8H2,1-2H3,(H,13,14)/t12-/m1/s1
InChIKeyABEVOGWDHHHUJS-GFCCVEGCSA-N
XLogP1.00
TPSA75.99 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.25
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze (2R)-2-hydroxy-2-[4-(2-methoxyethoxy)phenyl]propanoic 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-hydroxy-2-(4-propoxyphenyl)propanoic acid
CID 61237802
2,2-difluoro-2-[4-(2-methoxyethoxy)phenyl]acetic acid
CID 118647089
(2S)-2-hydroxy-2-(4-phenylmethoxyphenyl)propanoic acid
CID 131871320
2-[[4-(2-methoxyethoxy)benzoyl]amino]-2-methylpropanoic acid
CID 75383535
2-[4-(2-methoxyethoxy)phenyl]propan-2-amine
CID 95440689
2-hydroxy-1-[4-(2-methoxyethoxy)phenyl]-2-methylpropan-1-one
CID 20659085
benzoic acid;bis(4-(2-methoxyethoxy)benzoic acid)
CID 91308161
N-(1-amino-2-methylpropan-2-yl)-4-(2-methoxyethoxy)benzamide
CID 119523172
2-hydroxy-2-[4-(trifluoromethylsulfonyloxy)phenyl]propanoic acid
CID 101487578
1,3-bis[4-[2-[4-(2-methoxyethoxy)phenyl]propan-2-yl]phenoxy]propan-2-ol
CID 20661045
(2R)-2-hydroxy-2-(4-methylphenyl)propanoic acid
CID 21123439
2-hydroxy-3-[4-(2-methoxyethoxy)phenoxy]propanoic acid
CID 102149815

Frequently Asked Questions

What is the IUPAC name of (2R)-2-hydroxy-2-[4-(2-methoxyethoxy)phenyl]propanoic acid?
The IUPAC name of (2R)-2-hydroxy-2-[4-(2-methoxyethoxy)phenyl]propanoic acid (CID 70114787) is (2R)-2-hydroxy-2-[4-(2-methoxyethoxy)phenyl]propanoic acid.
What is the SMILES notation for (2R)-2-hydroxy-2-[4-(2-methoxyethoxy)phenyl]propanoic acid?
The canonical SMILES for (2R)-2-hydroxy-2-[4-(2-methoxyethoxy)phenyl]propanoic acid is COCCOc1ccc([C@@](C)(O)C(=O)O)cc1.
What is the InChIKey of (2R)-2-hydroxy-2-[4-(2-methoxyethoxy)phenyl]propanoic acid?
The InChIKey is ABEVOGWDHHHUJS-GFCCVEGCSA-N. The full InChI is InChI=1S/C12H16O5/c1-12(15,11(13)14)9-3-5-10(6-4-9)17-8-7-16-2/h3-6,15H,7-8H2,1-2H3,(H,13,14)/t12-/m1/s1.
What are the key properties of (2R)-2-hydroxy-2-[4-(2-methoxyethoxy)phenyl]propanoic acid?
(2R)-2-hydroxy-2-[4-(2-methoxyethoxy)phenyl]propanoic acid has a molecular weight of 240.25 g/mol, XLogP of 1.00, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-hydroxy-2-[4-(2-methoxyethoxy)phenyl]propanoic acid is sourced from PubChem (CID 70114787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).