2-ethoxy-2-phenyl-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanol

C18H28O3 — CID 114622770

IUPAC2-ethoxy-2-phenyl-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanol
SMILESCCOC(c1ccccc1)C(O)C1CC(C)(C)OC1(C)C
InChIInChI=1S/C18H28O3/c1-6-20-16(13-10-8-7-9-11-13)15(19)14-12-17(2,3)21-18(14,4)5/h7-11,14-16,19H,6,12H2,1-5H3
InChIKeyAJAZFNYLIDOCSB-UHFFFAOYSA-N
MW292.42 g/mol
LogP3.72
Rot. Bonds5

About 2-ethoxy-2-phenyl-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanol

2-ethoxy-2-phenyl-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanol (PubChem CID 114622770) has the molecular formula C18H28O3 and a molecular weight of 292.42 g/mol. Its IUPAC name is 2-ethoxy-2-phenyl-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanol.

Molecular Properties

Compound Name2-ethoxy-2-phenyl-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanol
PubChem CID114622770
Molecular FormulaC18H28O3
Molecular Weight292.42 g/mol
Exact Mass292.20
IUPAC Name2-ethoxy-2-phenyl-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanol
SMILESCCOC(c1ccccc1)C(O)C1CC(C)(C)OC1(C)C
InChIInChI=1S/C18H28O3/c1-6-20-16(13-10-8-7-9-11-13)15(19)14-12-17(2,3)21-18(14,4)5/h7-11,14-16,19H,6,12H2,1-5H3
InChIKeyAJAZFNYLIDOCSB-UHFFFAOYSA-N
XLogP3.72
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.42
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-ethoxy-2-phenyl-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanone
CID 114622575
3-phenyl-1-(2,2,5,5-tetramethyloxolan-3-yl)propan-1-ol
CID 114622047
3-phenoxy-1-(2,2,5,5-tetramethyloxolan-3-yl)propan-1-ol
CID 114622577
2-ethoxy-1,2-diphenylethanol
CID 3767197
(2-ethoxyphenyl)-(2,2,5,5-tetramethyloxolan-3-yl)methanamine
CID 114623421
(4-methylphenyl)-(2,2,5,5-tetramethyloxolan-3-yl)methanol
CID 114622000
N-ethyl-2-phenyl-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanamine
CID 114622837
2-(2,6-difluorophenyl)-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanol
CID 115838834
(1-ethoxy-4-methylcyclohexyl)-(2,2,5,5-tetramethyloxolan-3-yl)methanol
CID 114622761
[(1S,2S)-1-ethoxy-2-methoxy-2-phenylethyl]benzene
CID 143834566
(2-propylpyrazol-3-yl)-(2,2,5,5-tetramethyloxolan-3-yl)methanol
CID 114622236
(3R,6S)-1,8-diethoxy-2,3,6,7-tetrahydroxy-1,8-diphenyloctane-4,5-dione
CID 54296354

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-2-phenyl-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanol?
The IUPAC name of 2-ethoxy-2-phenyl-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanol (CID 114622770) is 2-ethoxy-2-phenyl-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanol.
What is the SMILES notation for 2-ethoxy-2-phenyl-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanol?
The canonical SMILES for 2-ethoxy-2-phenyl-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanol is CCOC(c1ccccc1)C(O)C1CC(C)(C)OC1(C)C.
What is the InChIKey of 2-ethoxy-2-phenyl-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanol?
The InChIKey is AJAZFNYLIDOCSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28O3/c1-6-20-16(13-10-8-7-9-11-13)15(19)14-12-17(2,3)21-18(14,4)5/h7-11,14-16,19H,6,12H2,1-5H3.
What are the key properties of 2-ethoxy-2-phenyl-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanol?
2-ethoxy-2-phenyl-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanol has a molecular weight of 292.42 g/mol, XLogP of 3.72, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-2-phenyl-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanol is sourced from PubChem (CID 114622770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).