3-methoxy-2-(2-methoxyphenoxy)propanoic acid

C11H14O5 — CID 103223945

IUPAC3-methoxy-2-(2-methoxyphenoxy)propanoic acid
SMILESCOCC(Oc1ccccc1OC)C(=O)O
InChIInChI=1S/C11H14O5/c1-14-7-10(11(12)13)16-9-6-4-3-5-8(9)15-2/h3-6,10H,7H2,1-2H3,(H,12,13)
InChIKeyQKERFICXUQRGNS-UHFFFAOYSA-N
MW226.23 g/mol
LogP1.17
Rot. Bonds6

About 3-methoxy-2-(2-methoxyphenoxy)propanoic acid

3-methoxy-2-(2-methoxyphenoxy)propanoic acid (PubChem CID 103223945) has the molecular formula C11H14O5 and a molecular weight of 226.23 g/mol. Its IUPAC name is 3-methoxy-2-(2-methoxyphenoxy)propanoic acid.

Molecular Properties

Compound Name3-methoxy-2-(2-methoxyphenoxy)propanoic acid
PubChem CID103223945
Molecular FormulaC11H14O5
Molecular Weight226.23 g/mol
Exact Mass226.08
IUPAC Name3-methoxy-2-(2-methoxyphenoxy)propanoic acid
SMILESCOCC(Oc1ccccc1OC)C(=O)O
InChIInChI=1S/C11H14O5/c1-14-7-10(11(12)13)16-9-6-4-3-5-8(9)15-2/h3-6,10H,7H2,1-2H3,(H,12,13)
InChIKeyQKERFICXUQRGNS-UHFFFAOYSA-N
XLogP1.17
TPSA64.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.23
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-methoxyphenoxy)-3-(2-methoxyphenyl)propanoic acid
CID 133240977
2-(2-methoxyphenoxy)decanoic acid
CID 21317194
(2S)-3-(4-ethylphenyl)-2-(2-methoxyphenoxy)propanoic acid
CID 100530459
(2R)-2-(2-methoxyphenoxy)-3-(2-phenoxyphenyl)propanoic acid
CID 100551442
2-(2-methoxyphenoxy)-3-(4-phenoxyphenyl)propanoic acid
CID 133241102
2-(2-methoxyphenoxy)-3-(2,4,6-trimethylphenyl)propanoic acid
CID 133241387
3-(5-chloro-2-methoxyphenyl)-2-(2-methoxyphenoxy)propanoic acid
CID 133241219
1-methoxy-2-[(1R)-2-methoxy-1-phenylethoxy]benzene
CID 139888612
2,3-dimethoxy-1-phenylpropan-1-one
CID 90073170
3-(4-chloro-2-methylphenyl)-2-(2-methoxyphenoxy)propanoic acid
CID 133230900
3-(2-methoxyphenoxy)-2-methylpropanoic acid
CID 43537701
2,9-bis(2-methoxyphenoxy)decanedioyl dichloride
CID 102377700

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-2-(2-methoxyphenoxy)propanoic acid?
The IUPAC name of 3-methoxy-2-(2-methoxyphenoxy)propanoic acid (CID 103223945) is 3-methoxy-2-(2-methoxyphenoxy)propanoic acid.
What is the SMILES notation for 3-methoxy-2-(2-methoxyphenoxy)propanoic acid?
The canonical SMILES for 3-methoxy-2-(2-methoxyphenoxy)propanoic acid is COCC(Oc1ccccc1OC)C(=O)O.
What is the InChIKey of 3-methoxy-2-(2-methoxyphenoxy)propanoic acid?
The InChIKey is QKERFICXUQRGNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14O5/c1-14-7-10(11(12)13)16-9-6-4-3-5-8(9)15-2/h3-6,10H,7H2,1-2H3,(H,12,13).
What are the key properties of 3-methoxy-2-(2-methoxyphenoxy)propanoic acid?
3-methoxy-2-(2-methoxyphenoxy)propanoic acid has a molecular weight of 226.23 g/mol, XLogP of 1.17, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-2-(2-methoxyphenoxy)propanoic acid is sourced from PubChem (CID 103223945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).