methyl 2-[3-(2-hydroxyethoxy)phenyl]acetate

C11H14O4 — CID 134821202

IUPACmethyl 2-[3-(2-hydroxyethoxy)phenyl]acetate
SMILESCOC(=O)Cc1cccc(OCCO)c1
InChIInChI=1S/C11H14O4/c1-14-11(13)8-9-3-2-4-10(7-9)15-6-5-12/h2-4,7,12H,5-6,8H2,1H3
InChIKeyLWCIUXUPCVNILS-UHFFFAOYSA-N
MW210.23 g/mol
LogP0.77
Rot. Bonds5

About methyl 2-[3-(2-hydroxyethoxy)phenyl]acetate

methyl 2-[3-(2-hydroxyethoxy)phenyl]acetate (PubChem CID 134821202) has the molecular formula C11H14O4 and a molecular weight of 210.23 g/mol. Its IUPAC name is methyl 2-[3-(2-hydroxyethoxy)phenyl]acetate.

Molecular Properties

Compound Namemethyl 2-[3-(2-hydroxyethoxy)phenyl]acetate
PubChem CID134821202
Molecular FormulaC11H14O4
Molecular Weight210.23 g/mol
Exact Mass210.09
IUPAC Namemethyl 2-[3-(2-hydroxyethoxy)phenyl]acetate
SMILESCOC(=O)Cc1cccc(OCCO)c1
InChIInChI=1S/C11H14O4/c1-14-11(13)8-9-3-2-4-10(7-9)15-6-5-12/h2-4,7,12H,5-6,8H2,1H3
InChIKeyLWCIUXUPCVNILS-UHFFFAOYSA-N
XLogP0.77
TPSA55.76 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.23
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze methyl 2-[3-(2-hydroxyethoxy)phenyl]acetate 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

methyl 2-[3-[3-(dimethylamino)propoxy]phenyl]acetate
CID 153300961
methyl 2-[3-[2-(1,3-dioxoisoindol-2-yl)ethoxy]phenyl]acetate
CID 14917019
CID 58539714
CID 58539714
methyl 5-[3-(3-hydroxypropyl)phenoxy]pentanoate
CID 10400711
methyl 2-[4-[[1-[[3-(2-hydroxyethoxy)phenyl]methyl]pyrrolidin-3-yl]methyl]phenyl]acetate;hydrochloride
CID 171711182
methyl 2-[3-[[3,5-bis(trifluoromethyl)phenyl]methoxy]phenyl]acetate
CID 173335814
2-[3-(aminomethyl)phenoxy]ethanol
CID 21465373
methyl 6-[3-[2-(diethylamino)-2-oxoethyl]phenoxy]hexanoate
CID 91465715
tert-butyl N-[[3-(2-hydroxyethoxy)phenyl]methyl]carbamate
CID 167192366
2-[3-(2-methoxy-2-oxoethyl)phenyl]ethanethioic S-acid
CID 87853811
methyl 2-[3-(methoxymethyl)phenyl]acetate
CID 131730198
methyl 2-[3-[3-(4-phenoxy-2-propylphenoxy)propoxy]phenyl]acetate
CID 22459062

Frequently Asked Questions

What is the IUPAC name of methyl 2-[3-(2-hydroxyethoxy)phenyl]acetate?
The IUPAC name of methyl 2-[3-(2-hydroxyethoxy)phenyl]acetate (CID 134821202) is methyl 2-[3-(2-hydroxyethoxy)phenyl]acetate.
What is the SMILES notation for methyl 2-[3-(2-hydroxyethoxy)phenyl]acetate?
The canonical SMILES for methyl 2-[3-(2-hydroxyethoxy)phenyl]acetate is COC(=O)Cc1cccc(OCCO)c1.
What is the InChIKey of methyl 2-[3-(2-hydroxyethoxy)phenyl]acetate?
The InChIKey is LWCIUXUPCVNILS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14O4/c1-14-11(13)8-9-3-2-4-10(7-9)15-6-5-12/h2-4,7,12H,5-6,8H2,1H3.
What are the key properties of methyl 2-[3-(2-hydroxyethoxy)phenyl]acetate?
methyl 2-[3-(2-hydroxyethoxy)phenyl]acetate has a molecular weight of 210.23 g/mol, XLogP of 0.77, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[3-(2-hydroxyethoxy)phenyl]acetate is sourced from PubChem (CID 134821202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).