(4-hydroxyphenyl)methyl 2-(4-hydroxyphenyl)acetate

C15H14O4 — CID 141285444

IUPAC(4-hydroxyphenyl)methyl 2-(4-hydroxyphenyl)acetate
SMILESO=C(Cc1ccc(O)cc1)OCc1ccc(O)cc1
InChIInChI=1S/C15H14O4/c16-13-5-1-11(2-6-13)9-15(18)19-10-12-3-7-14(17)8-4-12/h1-8,16-17H,9-10H2
InChIKeyAEFDAQSQSQHFPO-UHFFFAOYSA-N
MW258.27 g/mol
LogP2.38
Rot. Bonds4

About (4-hydroxyphenyl)methyl 2-(4-hydroxyphenyl)acetate

(4-hydroxyphenyl)methyl 2-(4-hydroxyphenyl)acetate (PubChem CID 141285444) has the molecular formula C15H14O4 and a molecular weight of 258.27 g/mol. Its IUPAC name is (4-hydroxyphenyl)methyl 2-(4-hydroxyphenyl)acetate.

Molecular Properties

Compound Name(4-hydroxyphenyl)methyl 2-(4-hydroxyphenyl)acetate
PubChem CID141285444
Molecular FormulaC15H14O4
Molecular Weight258.27 g/mol
Exact Mass258.09
IUPAC Name(4-hydroxyphenyl)methyl 2-(4-hydroxyphenyl)acetate
SMILESO=C(Cc1ccc(O)cc1)OCc1ccc(O)cc1
InChIInChI=1S/C15H14O4/c16-13-5-1-11(2-6-13)9-15(18)19-10-12-3-7-14(17)8-4-12/h1-8,16-17H,9-10H2
InChIKeyAEFDAQSQSQHFPO-UHFFFAOYSA-N
XLogP2.38
TPSA66.76 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.27
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

prop-2-enyl 2-(4-hydroxyphenyl)acetate
CID 11275537
(3,5-ditert-butyl-4-hydroxyphenyl)methyl 2-(4-hydroxyphenyl)acetate
CID 59265270
(4-chlorophenyl)methyl 2-(4-aminophenyl)acetate
CID 61323404
(4-hydroxyphenyl)methyl hydrogen carbonate
CID 19956654
pyridin-4-ylmethyl 2-(4-aminophenyl)acetate
CID 61321694
2-(4-hydroxyphenyl)ethyl 2-phenylacetate
CID 24850763
[[4,6-bis[[2-(4-hydroxyphenyl)acetyl]oxymethylamino]-1,3,5-triazin-2-yl]amino]methyl 2-(4-hydroxyphenyl)acetate
CID 122595443
benzyl 2-(3,4-dihydroxyphenyl)acetate
CID 155541666
benzyl 2-(4-acetylphenyl)acetate
CID 121231799
1,3-bis(4-hydroxyphenyl)propan-2-one
CID 159297209
(4-ethenylphenyl)methyl 2-phenylacetate
CID 164760837
methyl 2-[4-(4-hydroxyphenyl)phenyl]acetate
CID 86088038

Frequently Asked Questions

What is the IUPAC name of (4-hydroxyphenyl)methyl 2-(4-hydroxyphenyl)acetate?
The IUPAC name of (4-hydroxyphenyl)methyl 2-(4-hydroxyphenyl)acetate (CID 141285444) is (4-hydroxyphenyl)methyl 2-(4-hydroxyphenyl)acetate.
What is the SMILES notation for (4-hydroxyphenyl)methyl 2-(4-hydroxyphenyl)acetate?
The canonical SMILES for (4-hydroxyphenyl)methyl 2-(4-hydroxyphenyl)acetate is O=C(Cc1ccc(O)cc1)OCc1ccc(O)cc1.
What is the InChIKey of (4-hydroxyphenyl)methyl 2-(4-hydroxyphenyl)acetate?
The InChIKey is AEFDAQSQSQHFPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14O4/c16-13-5-1-11(2-6-13)9-15(18)19-10-12-3-7-14(17)8-4-12/h1-8,16-17H,9-10H2.
What are the key properties of (4-hydroxyphenyl)methyl 2-(4-hydroxyphenyl)acetate?
(4-hydroxyphenyl)methyl 2-(4-hydroxyphenyl)acetate has a molecular weight of 258.27 g/mol, XLogP of 2.38, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-hydroxyphenyl)methyl 2-(4-hydroxyphenyl)acetate is sourced from PubChem (CID 141285444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).