2-ethoxy-2-phenylethanol

C10H14O2 — CID 3015860

IUPAC2-ethoxy-2-phenylethanol
SMILESCCOC(CO)c1ccccc1
InChIInChI=1S/C10H14O2/c1-2-12-10(8-11)9-6-4-3-5-7-9/h3-7,10-11H,2,8H2,1H3
InChIKeyQISVRAXIZYUGJB-UHFFFAOYSA-N
MW166.22 g/mol
LogP1.76
Rot. Bonds4

About 2-ethoxy-2-phenylethanol

2-ethoxy-2-phenylethanol (PubChem CID 3015860) has the molecular formula C10H14O2 and a molecular weight of 166.22 g/mol. Its IUPAC name is 2-ethoxy-2-phenylethanol.

Molecular Properties

Compound Name2-ethoxy-2-phenylethanol
PubChem CID3015860
Molecular FormulaC10H14O2
Molecular Weight166.22 g/mol
Exact Mass166.10
IUPAC Name2-ethoxy-2-phenylethanol
SMILESCCOC(CO)c1ccccc1
InChIInChI=1S/C10H14O2/c1-2-12-10(8-11)9-6-4-3-5-7-9/h3-7,10-11H,2,8H2,1H3
InChIKeyQISVRAXIZYUGJB-UHFFFAOYSA-N
XLogP1.76
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.22
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-2-phenylethanol?
The IUPAC name of 2-ethoxy-2-phenylethanol (CID 3015860) is 2-ethoxy-2-phenylethanol.
What is the SMILES notation for 2-ethoxy-2-phenylethanol?
The canonical SMILES for 2-ethoxy-2-phenylethanol is CCOC(CO)c1ccccc1.
What is the InChIKey of 2-ethoxy-2-phenylethanol?
The InChIKey is QISVRAXIZYUGJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14O2/c1-2-12-10(8-11)9-6-4-3-5-7-9/h3-7,10-11H,2,8H2,1H3.
What are the key properties of 2-ethoxy-2-phenylethanol?
2-ethoxy-2-phenylethanol has a molecular weight of 166.22 g/mol, XLogP of 1.76, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-2-phenylethanol is sourced from PubChem (CID 3015860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).