methyl 2-(4-ethenyl-2-methoxyphenoxy)acetate

C12H14O4 — CID 167145651

IUPACmethyl 2-(4-ethenyl-2-methoxyphenoxy)acetate
SMILESC=Cc1ccc(OCC(=O)OC)c(OC)c1
InChIInChI=1S/C12H14O4/c1-4-9-5-6-10(11(7-9)14-2)16-8-12(13)15-3/h4-7H,1,8H2,2-3H3
InChIKeyGOVXYUIUAUKXLD-UHFFFAOYSA-N
MW222.24 g/mol
LogP1.89
Rot. Bonds5

About methyl 2-(4-ethenyl-2-methoxyphenoxy)acetate

methyl 2-(4-ethenyl-2-methoxyphenoxy)acetate (PubChem CID 167145651) has the molecular formula C12H14O4 and a molecular weight of 222.24 g/mol. Its IUPAC name is methyl 2-(4-ethenyl-2-methoxyphenoxy)acetate.

Molecular Properties

Compound Namemethyl 2-(4-ethenyl-2-methoxyphenoxy)acetate
PubChem CID167145651
Molecular FormulaC12H14O4
Molecular Weight222.24 g/mol
Exact Mass222.09
IUPAC Namemethyl 2-(4-ethenyl-2-methoxyphenoxy)acetate
SMILESC=Cc1ccc(OCC(=O)OC)c(OC)c1
InChIInChI=1S/C12H14O4/c1-4-9-5-6-10(11(7-9)14-2)16-8-12(13)15-3/h4-7H,1,8H2,2-3H3
InChIKeyGOVXYUIUAUKXLD-UHFFFAOYSA-N
XLogP1.89
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.24
LogP ≤ 51.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 2-(4-formyl-2-methoxyphenoxy)acetate
CID 882523
methyl (E)-3-[3-methoxy-4-(2-methoxy-2-oxoethoxy)phenyl]prop-2-enoate
CID 16764845
methyl 2-(4-ethenyl-2-iodo-6-methoxyphenoxy)acetate
CID 167145356
methyl 2-[4-[(1E,3Z,6E)-3-hydroxy-7-[3-methoxy-4-(2-methoxy-2-oxoethoxy)phenyl]-5-oxohepta-1,3,6-trienyl]-2-methoxyphenoxy]acetate
CID 10414053
ethyl (Z)-3-[3-methoxy-4-(2-methoxy-2-oxoethoxy)phenyl]prop-2-enoate
CID 92908749
4-ethenyl-1,2-dimethoxybenzene
CID 159733418
4-ethenyl-2-methoxy-1-(methoxymethoxy)benzene
CID 59623316
methyl 2-[2-methoxy-4-[(E)-1,2,4-triazol-4-yliminomethyl]phenoxy]acetate
CID 5344281
ethyl 2-(4-formyl-2-methoxyphenoxy)acetate
CID 968872
methyl 2-[2-methoxy-4-[(E)-(1-methyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]phenoxy]acetate
CID 2241984
methyl 2-[2-methoxy-4-(methylaminomethyl)phenoxy]acetate
CID 60882991
methyl 2-[2-(2-methoxy-2-oxoethoxy)-4-prop-2-enylphenoxy]acetate
CID 67377849

Frequently Asked Questions

What is the IUPAC name of methyl 2-(4-ethenyl-2-methoxyphenoxy)acetate?
The IUPAC name of methyl 2-(4-ethenyl-2-methoxyphenoxy)acetate (CID 167145651) is methyl 2-(4-ethenyl-2-methoxyphenoxy)acetate.
What is the SMILES notation for methyl 2-(4-ethenyl-2-methoxyphenoxy)acetate?
The canonical SMILES for methyl 2-(4-ethenyl-2-methoxyphenoxy)acetate is C=Cc1ccc(OCC(=O)OC)c(OC)c1.
What is the InChIKey of methyl 2-(4-ethenyl-2-methoxyphenoxy)acetate?
The InChIKey is GOVXYUIUAUKXLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14O4/c1-4-9-5-6-10(11(7-9)14-2)16-8-12(13)15-3/h4-7H,1,8H2,2-3H3.
What are the key properties of methyl 2-(4-ethenyl-2-methoxyphenoxy)acetate?
methyl 2-(4-ethenyl-2-methoxyphenoxy)acetate has a molecular weight of 222.24 g/mol, XLogP of 1.89, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-(4-ethenyl-2-methoxyphenoxy)acetate is sourced from PubChem (CID 167145651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).