prop-2-enyl 2-(4-hydroxyphenyl)acetate

C11H12O3 — CID 11275537

IUPACprop-2-enyl 2-(4-hydroxyphenyl)acetate
SMILESC=CCOC(=O)Cc1ccc(O)cc1
InChIInChI=1S/C11H12O3/c1-2-7-14-11(13)8-9-3-5-10(12)6-4-9/h2-6,12H,1,7-8H2
InChIKeyZDCGILKOCUVTLJ-UHFFFAOYSA-N
MW192.21 g/mol
LogP1.66
Rot. Bonds4

About prop-2-enyl 2-(4-hydroxyphenyl)acetate

prop-2-enyl 2-(4-hydroxyphenyl)acetate (PubChem CID 11275537) has the molecular formula C11H12O3 and a molecular weight of 192.21 g/mol. Its IUPAC name is prop-2-enyl 2-(4-hydroxyphenyl)acetate.

Molecular Properties

Compound Nameprop-2-enyl 2-(4-hydroxyphenyl)acetate
PubChem CID11275537
Molecular FormulaC11H12O3
Molecular Weight192.21 g/mol
Exact Mass192.08
IUPAC Nameprop-2-enyl 2-(4-hydroxyphenyl)acetate
SMILESC=CCOC(=O)Cc1ccc(O)cc1
InChIInChI=1S/C11H12O3/c1-2-7-14-11(13)8-9-3-5-10(12)6-4-9/h2-6,12H,1,7-8H2
InChIKeyZDCGILKOCUVTLJ-UHFFFAOYSA-N
XLogP1.66
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.21
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of prop-2-enyl 2-(4-hydroxyphenyl)acetate?
The IUPAC name of prop-2-enyl 2-(4-hydroxyphenyl)acetate (CID 11275537) is prop-2-enyl 2-(4-hydroxyphenyl)acetate.
What is the SMILES notation for prop-2-enyl 2-(4-hydroxyphenyl)acetate?
The canonical SMILES for prop-2-enyl 2-(4-hydroxyphenyl)acetate is C=CCOC(=O)Cc1ccc(O)cc1.
What is the InChIKey of prop-2-enyl 2-(4-hydroxyphenyl)acetate?
The InChIKey is ZDCGILKOCUVTLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12O3/c1-2-7-14-11(13)8-9-3-5-10(12)6-4-9/h2-6,12H,1,7-8H2.
What are the key properties of prop-2-enyl 2-(4-hydroxyphenyl)acetate?
prop-2-enyl 2-(4-hydroxyphenyl)acetate has a molecular weight of 192.21 g/mol, XLogP of 1.66, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for prop-2-enyl 2-(4-hydroxyphenyl)acetate is sourced from PubChem (CID 11275537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).