ethyl 3-[2-(2-hydroxyphenyl)phenyl]propanoate

C17H18O3 — CID 67626781

IUPACethyl 3-[2-(2-hydroxyphenyl)phenyl]propanoate
SMILESCCOC(=O)CCc1ccccc1-c1ccccc1O
InChIInChI=1S/C17H18O3/c1-2-20-17(19)12-11-13-7-3-4-8-14(13)15-9-5-6-10-16(15)18/h3-10,18H,2,11-12H2,1H3
InChIKeyUEGJHJUMZIYTMG-UHFFFAOYSA-N
MW270.33 g/mol
LogP3.55
Rot. Bonds5

About ethyl 3-[2-(2-hydroxyphenyl)phenyl]propanoate

ethyl 3-[2-(2-hydroxyphenyl)phenyl]propanoate (PubChem CID 67626781) has the molecular formula C17H18O3 and a molecular weight of 270.33 g/mol. Its IUPAC name is ethyl 3-[2-(2-hydroxyphenyl)phenyl]propanoate.

Molecular Properties

Compound Nameethyl 3-[2-(2-hydroxyphenyl)phenyl]propanoate
PubChem CID67626781
Molecular FormulaC17H18O3
Molecular Weight270.33 g/mol
Exact Mass270.13
IUPAC Nameethyl 3-[2-(2-hydroxyphenyl)phenyl]propanoate
SMILESCCOC(=O)CCc1ccccc1-c1ccccc1O
InChIInChI=1S/C17H18O3/c1-2-20-17(19)12-11-13-7-3-4-8-14(13)15-9-5-6-10-16(15)18/h3-10,18H,2,11-12H2,1H3
InChIKeyUEGJHJUMZIYTMG-UHFFFAOYSA-N
XLogP3.55
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

ethyl 4-(2-hydroxyphenyl)butanoate
CID 22461645
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ethane;ethyl 2-(2-hydroxyphenyl)acetate
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ethyl 3-[2-(1,1-difluoroethyl)phenyl]propanoate
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ethyl 3-(5-amino-2-hydroxyphenyl)propanoate
CID 3847295
ethyl 6-(2-methylphenyl)-4-oxohexanoate
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ethyl 3-[2-(methoxymethoxy)phenyl]propanoate
CID 102097984
ethyl 3-[2-[(3-hydroxyphenyl)methyl]phenyl]propanoate
CID 59684927
ethyl 2-[2-(3-oxobutyl)phenyl]acetate
CID 101402561
ethyl 3-(4-hydroxy-2,5-dimethylphenyl)propanoate
CID 58566683
ethyl 3-(3-methoxy-2-methylphenyl)propanoate
CID 68850412
(E)-3-[2-(3-ethoxy-3-oxopropyl)phenyl]prop-2-enoic acid
CID 166641850

Frequently Asked Questions

What is the IUPAC name of ethyl 3-[2-(2-hydroxyphenyl)phenyl]propanoate?
The IUPAC name of ethyl 3-[2-(2-hydroxyphenyl)phenyl]propanoate (CID 67626781) is ethyl 3-[2-(2-hydroxyphenyl)phenyl]propanoate.
What is the SMILES notation for ethyl 3-[2-(2-hydroxyphenyl)phenyl]propanoate?
The canonical SMILES for ethyl 3-[2-(2-hydroxyphenyl)phenyl]propanoate is CCOC(=O)CCc1ccccc1-c1ccccc1O.
What is the InChIKey of ethyl 3-[2-(2-hydroxyphenyl)phenyl]propanoate?
The InChIKey is UEGJHJUMZIYTMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18O3/c1-2-20-17(19)12-11-13-7-3-4-8-14(13)15-9-5-6-10-16(15)18/h3-10,18H,2,11-12H2,1H3.
What are the key properties of ethyl 3-[2-(2-hydroxyphenyl)phenyl]propanoate?
ethyl 3-[2-(2-hydroxyphenyl)phenyl]propanoate has a molecular weight of 270.33 g/mol, XLogP of 3.55, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 3-[2-(2-hydroxyphenyl)phenyl]propanoate is sourced from PubChem (CID 67626781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).