methyl 2-(2-ethoxyphenoxy)propanoate

C12H16O4 — CID 60643182

IUPACmethyl 2-(2-ethoxyphenoxy)propanoate
SMILESCCOc1ccccc1OC(C)C(=O)OC
InChIInChI=1S/C12H16O4/c1-4-15-10-7-5-6-8-11(10)16-9(2)12(13)14-3/h5-9H,4H2,1-3H3
InChIKeySWCDVXBOBBGEMF-UHFFFAOYSA-N
MW224.26 g/mol
LogP2.03
Rot. Bonds5

About methyl 2-(2-ethoxyphenoxy)propanoate

methyl 2-(2-ethoxyphenoxy)propanoate (PubChem CID 60643182) has the molecular formula C12H16O4 and a molecular weight of 224.26 g/mol. Its IUPAC name is methyl 2-(2-ethoxyphenoxy)propanoate.

Molecular Properties

Compound Namemethyl 2-(2-ethoxyphenoxy)propanoate
PubChem CID60643182
Molecular FormulaC12H16O4
Molecular Weight224.26 g/mol
Exact Mass224.10
IUPAC Namemethyl 2-(2-ethoxyphenoxy)propanoate
SMILESCCOc1ccccc1OC(C)C(=O)OC
InChIInChI=1S/C12H16O4/c1-4-15-10-7-5-6-8-11(10)16-9(2)12(13)14-3/h5-9H,4H2,1-3H3
InChIKeySWCDVXBOBBGEMF-UHFFFAOYSA-N
XLogP2.03
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 52.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-ethoxyphenoxy)propanoic acid
CID 16771653
methyl 2-(2-ethylphenoxy)propanoate
CID 60643103
methyl (2R)-2-(2-ethylphenoxy)propanoate
CID 103337851
methyl (2R)-2-(2-ethoxyphenoxy)-4-methylpentanoate
CID 114282388
methyl 2-[2-[(1R)-1-aminoethyl]phenoxy]propanoate
CID 63367072
methyl (2S)-2-[2-(hydroxymethyl)phenoxy]propanoate
CID 103338014
(2S)-N-(2,6-dimethylphenyl)-2-(2-ethoxyphenoxy)propanamide
CID 40872944
ethyl 2-[2-[(1S)-1-hydroxyethyl]phenoxy]propanoate
CID 78931073
methyl 2-(3-ethoxyphenoxy)propanoate
CID 62338439
4-(2-ethoxyphenoxy)pentan-2-one
CID 64698334
methyl 2-(2-acetamidophenoxy)propanoate
CID 54941686
(2R)-N-(4-acetylphenyl)-2-(2-ethoxyphenoxy)propanamide
CID 7840850

Frequently Asked Questions

What is the IUPAC name of methyl 2-(2-ethoxyphenoxy)propanoate?
The IUPAC name of methyl 2-(2-ethoxyphenoxy)propanoate (CID 60643182) is methyl 2-(2-ethoxyphenoxy)propanoate.
What is the SMILES notation for methyl 2-(2-ethoxyphenoxy)propanoate?
The canonical SMILES for methyl 2-(2-ethoxyphenoxy)propanoate is CCOc1ccccc1OC(C)C(=O)OC.
What is the InChIKey of methyl 2-(2-ethoxyphenoxy)propanoate?
The InChIKey is SWCDVXBOBBGEMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16O4/c1-4-15-10-7-5-6-8-11(10)16-9(2)12(13)14-3/h5-9H,4H2,1-3H3.
What are the key properties of methyl 2-(2-ethoxyphenoxy)propanoate?
methyl 2-(2-ethoxyphenoxy)propanoate has a molecular weight of 224.26 g/mol, XLogP of 2.03, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-(2-ethoxyphenoxy)propanoate is sourced from PubChem (CID 60643182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).