methyl 4-[[2-(2-ethoxyphenoxy)acetyl]oxymethyl]benzoate

C19H20O6 — CID 23856179

IUPACmethyl 4-[[2-(2-ethoxyphenoxy)acetyl]oxymethyl]benzoate
SMILESCCOc1ccccc1OCC(=O)OCc1ccc(C(=O)OC)cc1
InChIInChI=1S/C19H20O6/c1-3-23-16-6-4-5-7-17(16)24-13-18(20)25-12-14-8-10-15(11-9-14)19(21)22-2/h4-11H,3,12-13H2,1-2H3
InChIKeyMXNARCDXEQYRJR-UHFFFAOYSA-N
MW344.36 g/mol
LogP2.99
Rot. Bonds8

About methyl 4-[[2-(2-ethoxyphenoxy)acetyl]oxymethyl]benzoate

methyl 4-[[2-(2-ethoxyphenoxy)acetyl]oxymethyl]benzoate (PubChem CID 23856179) has the molecular formula C19H20O6 and a molecular weight of 344.36 g/mol. Its IUPAC name is methyl 4-[[2-(2-ethoxyphenoxy)acetyl]oxymethyl]benzoate.

Molecular Properties

Compound Namemethyl 4-[[2-(2-ethoxyphenoxy)acetyl]oxymethyl]benzoate
PubChem CID23856179
Molecular FormulaC19H20O6
Molecular Weight344.36 g/mol
Exact Mass344.13
IUPAC Namemethyl 4-[[2-(2-ethoxyphenoxy)acetyl]oxymethyl]benzoate
SMILESCCOc1ccccc1OCC(=O)OCc1ccc(C(=O)OC)cc1
InChIInChI=1S/C19H20O6/c1-3-23-16-6-4-5-7-17(16)24-13-18(20)25-12-14-8-10-15(11-9-14)19(21)22-2/h4-11H,3,12-13H2,1-2H3
InChIKeyMXNARCDXEQYRJR-UHFFFAOYSA-N
XLogP2.99
TPSA71.06 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.36
LogP ≤ 52.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze methyl 4-[[2-(2-ethoxyphenoxy)acetyl]oxymethyl]benzoate 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

benzyl propanoate;methyl benzoate
CID 70307580
propyl 2-(2-ethoxyphenoxy)acetate
CID 112724725
[2-(2-benzoylhydrazinyl)-2-oxoethyl] 2-(2-ethoxyphenoxy)acetate
CID 7844494
4-O-benzyl 1-O-methyl benzene-1,4-dicarboxylate
CID 595908
methyl 4-[[2-[(4-ethoxybenzoyl)amino]acetyl]oxymethyl]benzoate
CID 7884840
methyl 2-[(4-methoxycarbonylphenyl)methoxy]benzoate
CID 7894205
(4-nitrophenyl)methyl 2-(2-methoxyphenoxy)acetate
CID 8913485
benzyl 2-(4-cyano-2-ethoxyphenoxy)acetate
CID 27725620
butyl 2-(2-ethoxyphenoxy)acetate
CID 54941442
methyl 4-[(2-acetylphenoxy)methyl]benzoate
CID 9172369
methyl 4-(carbonochloridoyloxymethyl)benzoate
CID 54328192
(3,4,5-trimethoxyphenyl)methyl 2-(2-methoxyphenoxy)acetate
CID 18275421

Frequently Asked Questions

What is the IUPAC name of methyl 4-[[2-(2-ethoxyphenoxy)acetyl]oxymethyl]benzoate?
The IUPAC name of methyl 4-[[2-(2-ethoxyphenoxy)acetyl]oxymethyl]benzoate (CID 23856179) is methyl 4-[[2-(2-ethoxyphenoxy)acetyl]oxymethyl]benzoate.
What is the SMILES notation for methyl 4-[[2-(2-ethoxyphenoxy)acetyl]oxymethyl]benzoate?
The canonical SMILES for methyl 4-[[2-(2-ethoxyphenoxy)acetyl]oxymethyl]benzoate is CCOc1ccccc1OCC(=O)OCc1ccc(C(=O)OC)cc1.
What is the InChIKey of methyl 4-[[2-(2-ethoxyphenoxy)acetyl]oxymethyl]benzoate?
The InChIKey is MXNARCDXEQYRJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20O6/c1-3-23-16-6-4-5-7-17(16)24-13-18(20)25-12-14-8-10-15(11-9-14)19(21)22-2/h4-11H,3,12-13H2,1-2H3.
What are the key properties of methyl 4-[[2-(2-ethoxyphenoxy)acetyl]oxymethyl]benzoate?
methyl 4-[[2-(2-ethoxyphenoxy)acetyl]oxymethyl]benzoate has a molecular weight of 344.36 g/mol, XLogP of 2.99, 8 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 4-[[2-(2-ethoxyphenoxy)acetyl]oxymethyl]benzoate is sourced from PubChem (CID 23856179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).