2-(oxolan-3-yl)-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanol

C14H26O3 — CID 114622736

IUPAC2-(oxolan-3-yl)-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanol
SMILESCC1(C)CC(C(O)CC2CCOC2)C(C)(C)O1
InChIInChI=1S/C14H26O3/c1-13(2)8-11(14(3,4)17-13)12(15)7-10-5-6-16-9-10/h10-12,15H,5-9H2,1-4H3
InChIKeyJQLKAMHMQRRUBL-UHFFFAOYSA-N
MW242.36 g/mol
LogP2.37
Rot. Bonds3

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

2-(oxolan-3-yl)-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanol (PubChem CID 114622736) has the molecular formula C14H26O3 and a molecular weight of 242.36 g/mol. Its IUPAC name is 2-(oxolan-3-yl)-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanol.

Molecular Properties

Compound Name2-(oxolan-3-yl)-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanol
PubChem CID114622736
Molecular FormulaC14H26O3
Molecular Weight242.36 g/mol
Exact Mass242.19
IUPAC Name2-(oxolan-3-yl)-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanol
SMILESCC1(C)CC(C(O)CC2CCOC2)C(C)(C)O1
InChIInChI=1S/C14H26O3/c1-13(2)8-11(14(3,4)17-13)12(15)7-10-5-6-16-9-10/h10-12,15H,5-9H2,1-4H3
InChIKeyJQLKAMHMQRRUBL-UHFFFAOYSA-N
XLogP2.37
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyclopropyl-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanol
CID 114622710
[2-(oxolan-3-yl)-1-(2,2,5,5-tetramethyloxolan-3-yl)ethyl]hydrazine
CID 105266186
oxan-3-yl-(2,2,5,5-tetramethyloxolan-3-yl)methanol
CID 114622044
3,3-dimethyl-1-(2,2,5,5-tetramethyloxolan-3-yl)butan-1-ol
CID 114622056
3-methylsulfanyl-1-(2,2,5,5-tetramethyloxolan-3-yl)propan-1-ol
CID 114622050
1-(2-ethylcyclohexyl)-2-(oxolan-3-yl)ethanol
CID 103986438
3-(oxan-2-yl)-1-(2,2,5,5-tetramethyloxolan-3-yl)propan-1-ol
CID 115838835
1-(2,2,5,5-tetramethyloxolan-3-yl)decan-1-ol
CID 115838780
1-(3-methyloxolan-2-yl)-2-(oxolan-3-yl)ethanol
CID 130791848
2-(tert-butylamino)-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanol
CID 114624352
4-methoxy-1-(2,2,5,5-tetramethyloxolan-3-yl)pentan-1-ol
CID 105132000
1-adamantyl-(2,2,5,5-tetramethyloxolan-3-yl)methanol
CID 114622611

Frequently Asked Questions

What is the IUPAC name of 2-(oxolan-3-yl)-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanol?
The IUPAC name of 2-(oxolan-3-yl)-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanol (CID 114622736) is 2-(oxolan-3-yl)-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanol.
What is the SMILES notation for 2-(oxolan-3-yl)-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanol?
The canonical SMILES for 2-(oxolan-3-yl)-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanol is CC1(C)CC(C(O)CC2CCOC2)C(C)(C)O1.
What is the InChIKey of 2-(oxolan-3-yl)-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanol?
The InChIKey is JQLKAMHMQRRUBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26O3/c1-13(2)8-11(14(3,4)17-13)12(15)7-10-5-6-16-9-10/h10-12,15H,5-9H2,1-4H3.
What are the key properties of 2-(oxolan-3-yl)-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanol?
2-(oxolan-3-yl)-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanol has a molecular weight of 242.36 g/mol, XLogP of 2.37, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(oxolan-3-yl)-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanol is sourced from PubChem (CID 114622736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).