2-ethylphenol;2-phenylethanol

C16H20O2 — CID 157102342

IUPAC2-ethylphenol;2-phenylethanol
SMILESCCc1ccccc1O.OCCc1ccccc1
InChIInChI=1S/2C8H10O/c1-2-7-5-3-4-6-8(7)9;9-7-6-8-4-2-1-3-5-8/h3-6,9H,2H2,1H3;1-5,9H,6-7H2
InChIKeyAFXFNLYMSGDWJO-UHFFFAOYSA-N
MW244.33 g/mol
LogP3.18
Rot. Bonds3

About 2-ethylphenol;2-phenylethanol

2-ethylphenol;2-phenylethanol (PubChem CID 157102342) has the molecular formula C16H20O2 and a molecular weight of 244.33 g/mol. Its IUPAC name is 2-ethylphenol;2-phenylethanol.

Molecular Properties

Compound Name2-ethylphenol;2-phenylethanol
PubChem CID157102342
Molecular FormulaC16H20O2
Molecular Weight244.33 g/mol
Exact Mass244.15
IUPAC Name2-ethylphenol;2-phenylethanol
SMILESCCc1ccccc1O.OCCc1ccccc1
InChIInChI=1S/2C8H10O/c1-2-7-5-3-4-6-8(7)9;9-7-6-8-4-2-1-3-5-8/h3-6,9H,2H2,1H3;1-5,9H,6-7H2
InChIKeyAFXFNLYMSGDWJO-UHFFFAOYSA-N
XLogP3.18
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.33
LogP ≤ 53.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 2-ethylphenol;2-phenylethanol?
The IUPAC name of 2-ethylphenol;2-phenylethanol (CID 157102342) is 2-ethylphenol;2-phenylethanol.
What is the SMILES notation for 2-ethylphenol;2-phenylethanol?
The canonical SMILES for 2-ethylphenol;2-phenylethanol is CCc1ccccc1O.OCCc1ccccc1.
What is the InChIKey of 2-ethylphenol;2-phenylethanol?
The InChIKey is AFXFNLYMSGDWJO-UHFFFAOYSA-N. The full InChI is InChI=1S/2C8H10O/c1-2-7-5-3-4-6-8(7)9;9-7-6-8-4-2-1-3-5-8/h3-6,9H,2H2,1H3;1-5,9H,6-7H2.
What are the key properties of 2-ethylphenol;2-phenylethanol?
2-ethylphenol;2-phenylethanol has a molecular weight of 244.33 g/mol, XLogP of 3.18, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethylphenol;2-phenylethanol is sourced from PubChem (CID 157102342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).