1-[2-(oxolan-3-yloxy)phenyl]ethanol

C12H16O3 — CID 63558983

IUPAC1-[2-(oxolan-3-yloxy)phenyl]ethanol
SMILESCC(O)c1ccccc1OC1CCOC1
InChIInChI=1S/C12H16O3/c1-9(13)11-4-2-3-5-12(11)15-10-6-7-14-8-10/h2-5,9-10,13H,6-8H2,1H3
InChIKeyNDFGCBWSQVRZAP-UHFFFAOYSA-N
MW208.26 g/mol
LogP1.91
Rot. Bonds3

About 1-[2-(oxolan-3-yloxy)phenyl]ethanol

1-[2-(oxolan-3-yloxy)phenyl]ethanol (PubChem CID 63558983) has the molecular formula C12H16O3 and a molecular weight of 208.26 g/mol. Its IUPAC name is 1-[2-(oxolan-3-yloxy)phenyl]ethanol.

Molecular Properties

Compound Name1-[2-(oxolan-3-yloxy)phenyl]ethanol
PubChem CID63558983
Molecular FormulaC12H16O3
Molecular Weight208.26 g/mol
Exact Mass208.11
IUPAC Name1-[2-(oxolan-3-yloxy)phenyl]ethanol
SMILESCC(O)c1ccccc1OC1CCOC1
InChIInChI=1S/C12H16O3/c1-9(13)11-4-2-3-5-12(11)15-10-6-7-14-8-10/h2-5,9-10,13H,6-8H2,1H3
InChIKeyNDFGCBWSQVRZAP-UHFFFAOYSA-N
XLogP1.91
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[2-(oxolan-3-yloxy)phenyl]ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(1R)-1-[4-fluoro-2-(oxolan-3-yloxy)phenyl]ethanol
CID 63557560
1-[3-methoxy-2-(oxolan-3-yloxy)phenyl]ethanol
CID 117349251
(1S)-1-[2-(oxan-3-yloxy)phenyl]propan-1-ol
CID 107135067
(3S)-3-(2-methoxyphenoxy)oxolane
CID 141103497
1-[2-(oxan-4-yloxy)phenyl]ethanamine
CID 61288976
1-[2-(3,4-dimethylcyclohexyl)oxyphenyl]ethanol
CID 64738983
3-(4-fluoro-2-propan-2-ylphenoxy)oxolane
CID 164786398
1-[5-methyl-2-(oxan-3-yloxy)phenyl]ethanol
CID 107135051
(1R)-1-[4-methyl-2-(oxan-3-yloxy)phenyl]ethanol
CID 107135084
(1R)-1-[2-(3,5-dimethylcyclohexyl)oxyphenyl]ethanol
CID 78999226
N-methyl-1-[2-(oxan-4-yloxy)phenyl]ethanamine
CID 61287998
2-hydroxy-2-[2-methoxy-3-(oxolan-3-yloxy)phenyl]acetic acid
CID 117424076

Frequently Asked Questions

What is the IUPAC name of 1-[2-(oxolan-3-yloxy)phenyl]ethanol?
The IUPAC name of 1-[2-(oxolan-3-yloxy)phenyl]ethanol (CID 63558983) is 1-[2-(oxolan-3-yloxy)phenyl]ethanol.
What is the SMILES notation for 1-[2-(oxolan-3-yloxy)phenyl]ethanol?
The canonical SMILES for 1-[2-(oxolan-3-yloxy)phenyl]ethanol is CC(O)c1ccccc1OC1CCOC1.
What is the InChIKey of 1-[2-(oxolan-3-yloxy)phenyl]ethanol?
The InChIKey is NDFGCBWSQVRZAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16O3/c1-9(13)11-4-2-3-5-12(11)15-10-6-7-14-8-10/h2-5,9-10,13H,6-8H2,1H3.
What are the key properties of 1-[2-(oxolan-3-yloxy)phenyl]ethanol?
1-[2-(oxolan-3-yloxy)phenyl]ethanol has a molecular weight of 208.26 g/mol, XLogP of 1.91, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(oxolan-3-yloxy)phenyl]ethanol is sourced from PubChem (CID 63558983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).