5-ethyl-2-phenoxyphenol

C14H14O2 — CID 5274974

IUPAC5-ethyl-2-phenoxyphenol
SMILESCCc1ccc(Oc2ccccc2)c(O)c1
InChIInChI=1S/C14H14O2/c1-2-11-8-9-14(13(15)10-11)16-12-6-4-3-5-7-12/h3-10,15H,2H2,1H3
InChIKeyXZOPHRPAUNJURP-UHFFFAOYSA-N
MW214.26 g/mol
LogP3.75
Rot. Bonds3

About 5-ethyl-2-phenoxyphenol

5-ethyl-2-phenoxyphenol (PubChem CID 5274974) has the molecular formula C14H14O2 and a molecular weight of 214.26 g/mol. Its IUPAC name is 5-ethyl-2-phenoxyphenol.

Molecular Properties

Compound Name5-ethyl-2-phenoxyphenol
PubChem CID5274974
Molecular FormulaC14H14O2
Molecular Weight214.26 g/mol
Exact Mass214.10
IUPAC Name5-ethyl-2-phenoxyphenol
SMILESCCc1ccc(Oc2ccccc2)c(O)c1
InChIInChI=1S/C14H14O2/c1-2-11-8-9-14(13(15)10-11)16-12-6-4-3-5-7-12/h3-10,15H,2H2,1H3
InChIKeyXZOPHRPAUNJURP-UHFFFAOYSA-N
XLogP3.75
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.26
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-2-phenoxyphenol?
The IUPAC name of 5-ethyl-2-phenoxyphenol (CID 5274974) is 5-ethyl-2-phenoxyphenol.
What is the SMILES notation for 5-ethyl-2-phenoxyphenol?
The canonical SMILES for 5-ethyl-2-phenoxyphenol is CCc1ccc(Oc2ccccc2)c(O)c1.
What is the InChIKey of 5-ethyl-2-phenoxyphenol?
The InChIKey is XZOPHRPAUNJURP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14O2/c1-2-11-8-9-14(13(15)10-11)16-12-6-4-3-5-7-12/h3-10,15H,2H2,1H3.
What are the key properties of 5-ethyl-2-phenoxyphenol?
5-ethyl-2-phenoxyphenol has a molecular weight of 214.26 g/mol, XLogP of 3.75, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2-phenoxyphenol is sourced from PubChem (CID 5274974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).