2-(4-hydroxyphenyl)ethyl 2-phenylacetate

C16H16O3 — CID 24850763

IUPAC2-(4-hydroxyphenyl)ethyl 2-phenylacetate
SMILESO=C(Cc1ccccc1)OCCc1ccc(O)cc1
InChIInChI=1S/C16H16O3/c17-15-8-6-13(7-9-15)10-11-19-16(18)12-14-4-2-1-3-5-14/h1-9,17H,10-12H2
InChIKeyLEHFWRIESDDBMM-UHFFFAOYSA-N
MW256.30 g/mol
LogP2.72
Rot. Bonds5

About 2-(4-hydroxyphenyl)ethyl 2-phenylacetate

2-(4-hydroxyphenyl)ethyl 2-phenylacetate (PubChem CID 24850763) has the molecular formula C16H16O3 and a molecular weight of 256.30 g/mol. Its IUPAC name is 2-(4-hydroxyphenyl)ethyl 2-phenylacetate.

Molecular Properties

Compound Name2-(4-hydroxyphenyl)ethyl 2-phenylacetate
PubChem CID24850763
Molecular FormulaC16H16O3
Molecular Weight256.30 g/mol
Exact Mass256.11
IUPAC Name2-(4-hydroxyphenyl)ethyl 2-phenylacetate
SMILESO=C(Cc1ccccc1)OCCc1ccc(O)cc1
InChIInChI=1S/C16H16O3/c17-15-8-6-13(7-9-15)10-11-19-16(18)12-14-4-2-1-3-5-14/h1-9,17H,10-12H2
InChIKeyLEHFWRIESDDBMM-UHFFFAOYSA-N
XLogP2.72
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.30
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-phenylethyl 2-(3,4-dihydroxyphenyl)acetate
CID 138558195
2-phenylethyl 4-hydroxybenzoate
CID 11977778
(4-hydroxyphenyl)methyl 2-(4-hydroxyphenyl)acetate
CID 141285444
propyl 4-hydroxybenzoate;propyl 2-phenylacetate
CID 174922489
2-phenylethyl 2-(2-bromophenyl)acetate
CID 141456939
[2-(4-hydroxyphenyl)ethoxycarbonylamino]carbamic acid
CID 66863409
2-phenylethyl 2-(2-formylphenyl)acetate
CID 169081961
(2R)-2-[2-(4-hydroxyphenyl)ethoxycarbonylamino]oxy-3-phenylpropanoic acid
CID 163240313
4-(2-phenylacetyl)oxybut-2-enyl 2-phenylacetate
CID 139775168
2-(4-methylphenyl)ethyl 3-(4-hydroxyphenyl)propanoate
CID 58446609
2-(4-hydroxyphenyl)ethyl pentanoate
CID 54186146
5-O-benzyl 1-O-[2-(4-hydroxyphenyl)ethyl] 3-[(2-methoxy-2-oxoacetyl)amino]pentanedioate
CID 25161265

Frequently Asked Questions

What is the IUPAC name of 2-(4-hydroxyphenyl)ethyl 2-phenylacetate?
The IUPAC name of 2-(4-hydroxyphenyl)ethyl 2-phenylacetate (CID 24850763) is 2-(4-hydroxyphenyl)ethyl 2-phenylacetate.
What is the SMILES notation for 2-(4-hydroxyphenyl)ethyl 2-phenylacetate?
The canonical SMILES for 2-(4-hydroxyphenyl)ethyl 2-phenylacetate is O=C(Cc1ccccc1)OCCc1ccc(O)cc1.
What is the InChIKey of 2-(4-hydroxyphenyl)ethyl 2-phenylacetate?
The InChIKey is LEHFWRIESDDBMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16O3/c17-15-8-6-13(7-9-15)10-11-19-16(18)12-14-4-2-1-3-5-14/h1-9,17H,10-12H2.
What are the key properties of 2-(4-hydroxyphenyl)ethyl 2-phenylacetate?
2-(4-hydroxyphenyl)ethyl 2-phenylacetate has a molecular weight of 256.30 g/mol, XLogP of 2.72, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-hydroxyphenyl)ethyl 2-phenylacetate is sourced from PubChem (CID 24850763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).