methyl 2-[4-(4-hydroxyphenyl)phenyl]acetate

C15H14O3 — CID 86088038

IUPACmethyl 2-[4-(4-hydroxyphenyl)phenyl]acetate
SMILESCOC(=O)Cc1ccc(-c2ccc(O)cc2)cc1
InChIInChI=1S/C15H14O3/c1-18-15(17)10-11-2-4-12(5-3-11)13-6-8-14(16)9-7-13/h2-9,16H,10H2,1H3
InChIKeyASSGUXYTCDTUKC-UHFFFAOYSA-N
MW242.27 g/mol
LogP2.77
Rot. Bonds3

About methyl 2-[4-(4-hydroxyphenyl)phenyl]acetate

methyl 2-[4-(4-hydroxyphenyl)phenyl]acetate (PubChem CID 86088038) has the molecular formula C15H14O3 and a molecular weight of 242.27 g/mol. Its IUPAC name is methyl 2-[4-(4-hydroxyphenyl)phenyl]acetate.

Molecular Properties

Compound Namemethyl 2-[4-(4-hydroxyphenyl)phenyl]acetate
PubChem CID86088038
Molecular FormulaC15H14O3
Molecular Weight242.27 g/mol
Exact Mass242.09
IUPAC Namemethyl 2-[4-(4-hydroxyphenyl)phenyl]acetate
SMILESCOC(=O)Cc1ccc(-c2ccc(O)cc2)cc1
InChIInChI=1S/C15H14O3/c1-18-15(17)10-11-2-4-12(5-3-11)13-6-8-14(16)9-7-13/h2-9,16H,10H2,1H3
InChIKeyASSGUXYTCDTUKC-UHFFFAOYSA-N
XLogP2.77
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.27
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-hydroxyphenyl)acetic acid;methyl 2-(4-hydroxyphenyl)acetate
CID 159047656
methyl 2-[4-(4-ethylphenyl)phenyl]acetate
CID 20610301
[4-(4-hydroxyphenyl)phenyl] 4-[[4-(2-methoxy-2-oxoethyl)benzoyl]amino]benzoate
CID 89329547
methyl 2-[4-(3-methylphenyl)phenyl]acetate
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methyl 2-[4-(acetyloxymethyl)phenyl]acetate
CID 14793789
methyl 2-[4-(methylaminomethyl)phenyl]acetate
CID 23594251
sodium 4-(2-methoxy-2-oxoethyl)phenolate
CID 70152543
methyl 2-(4-aminophenyl)acetate;hydrochloride
CID 12918864
1-(bromomethyl)-4-methylbenzene;methyl 2-(4-methylphenyl)acetate
CID 158061256
methyl 2-[4-(2,4,6-trimethylphenyl)phenyl]acetate
CID 143366295
(4-hydroxyphenyl)methyl 2-(4-hydroxyphenyl)acetate
CID 141285444
CID 172801156
CID 172801156

Frequently Asked Questions

What is the IUPAC name of methyl 2-[4-(4-hydroxyphenyl)phenyl]acetate?
The IUPAC name of methyl 2-[4-(4-hydroxyphenyl)phenyl]acetate (CID 86088038) is methyl 2-[4-(4-hydroxyphenyl)phenyl]acetate.
What is the SMILES notation for methyl 2-[4-(4-hydroxyphenyl)phenyl]acetate?
The canonical SMILES for methyl 2-[4-(4-hydroxyphenyl)phenyl]acetate is COC(=O)Cc1ccc(-c2ccc(O)cc2)cc1.
What is the InChIKey of methyl 2-[4-(4-hydroxyphenyl)phenyl]acetate?
The InChIKey is ASSGUXYTCDTUKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14O3/c1-18-15(17)10-11-2-4-12(5-3-11)13-6-8-14(16)9-7-13/h2-9,16H,10H2,1H3.
What are the key properties of methyl 2-[4-(4-hydroxyphenyl)phenyl]acetate?
methyl 2-[4-(4-hydroxyphenyl)phenyl]acetate has a molecular weight of 242.27 g/mol, XLogP of 2.77, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[4-(4-hydroxyphenyl)phenyl]acetate is sourced from PubChem (CID 86088038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).