ethyl 2-(2-hydroxy-4-methylphenoxy)acetate

C11H14O4 — CID 67510779

IUPACethyl 2-(2-hydroxy-4-methylphenoxy)acetate
SMILESCCOC(=O)COc1ccc(C)cc1O
InChIInChI=1S/C11H14O4/c1-3-14-11(13)7-15-10-5-4-8(2)6-9(10)12/h4-6,12H,3,7H2,1-2H3
InChIKeySWYCTEZTWHUAFJ-UHFFFAOYSA-N
MW210.23 g/mol
LogP1.64
Rot. Bonds4

About ethyl 2-(2-hydroxy-4-methylphenoxy)acetate

ethyl 2-(2-hydroxy-4-methylphenoxy)acetate (PubChem CID 67510779) has the molecular formula C11H14O4 and a molecular weight of 210.23 g/mol. Its IUPAC name is ethyl 2-(2-hydroxy-4-methylphenoxy)acetate.

Molecular Properties

Compound Nameethyl 2-(2-hydroxy-4-methylphenoxy)acetate
PubChem CID67510779
Molecular FormulaC11H14O4
Molecular Weight210.23 g/mol
Exact Mass210.09
IUPAC Nameethyl 2-(2-hydroxy-4-methylphenoxy)acetate
SMILESCCOC(=O)COc1ccc(C)cc1O
InChIInChI=1S/C11H14O4/c1-3-14-11(13)7-15-10-5-4-8(2)6-9(10)12/h4-6,12H,3,7H2,1-2H3
InChIKeySWYCTEZTWHUAFJ-UHFFFAOYSA-N
XLogP1.64
TPSA55.76 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.23
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl 2-[2-(2-aminopropyl)-4-methylphenoxy]acetate
CID 63326114
ethyl 2-(2-methyl-4-sulfanylphenoxy)acetate
CID 16641178
ethyl 2-(2,4-dichlorophenoxy)acetate
CID 10780
ethyl 2-(4-chloro-2-methylphenoxy)acetate
CID 17603
ethyl 2-(4-iodo-2-methylphenoxy)acetate
CID 57361058
2-(2-methoxyethoxy)-5-methylphenol
CID 89108915
CID 88937368
CID 88937368
ethyl 2-[3,5-bis(2-ethoxy-2-oxoethoxy)phenoxy]acetate
CID 71361550
ethyl 2-[4-[4-(4-hydroxy-3-methylphenyl)heptan-4-yl]-2-methylphenoxy]acetate
CID 155549053
ethane;ethyl 2-(2,3,4-trimethoxyphenoxy)acetate
CID 144536056
butyl 2-(2-bromo-4-methylphenoxy)acetate
CID 54940989
ethyl 2-(2-methyl-4-propylphenoxy)acetate
CID 134426346

Frequently Asked Questions

What is the IUPAC name of ethyl 2-(2-hydroxy-4-methylphenoxy)acetate?
The IUPAC name of ethyl 2-(2-hydroxy-4-methylphenoxy)acetate (CID 67510779) is ethyl 2-(2-hydroxy-4-methylphenoxy)acetate.
What is the SMILES notation for ethyl 2-(2-hydroxy-4-methylphenoxy)acetate?
The canonical SMILES for ethyl 2-(2-hydroxy-4-methylphenoxy)acetate is CCOC(=O)COc1ccc(C)cc1O.
What is the InChIKey of ethyl 2-(2-hydroxy-4-methylphenoxy)acetate?
The InChIKey is SWYCTEZTWHUAFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14O4/c1-3-14-11(13)7-15-10-5-4-8(2)6-9(10)12/h4-6,12H,3,7H2,1-2H3.
What are the key properties of ethyl 2-(2-hydroxy-4-methylphenoxy)acetate?
ethyl 2-(2-hydroxy-4-methylphenoxy)acetate has a molecular weight of 210.23 g/mol, XLogP of 1.64, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-(2-hydroxy-4-methylphenoxy)acetate is sourced from PubChem (CID 67510779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).