1-[2-[2-(oxolan-2-ylmethoxy)ethoxy]ethoxy]propan-2-ol

C12H24O5 — CID 54459416

IUPAC1-[2-[2-(oxolan-2-ylmethoxy)ethoxy]ethoxy]propan-2-ol
SMILESCC(O)COCCOCCOCC1CCCO1
InChIInChI=1S/C12H24O5/c1-11(13)9-15-7-5-14-6-8-16-10-12-3-2-4-17-12/h11-13H,2-10H2,1H3
InChIKeyXAOBGQDBHYONTB-UHFFFAOYSA-N
MW248.32 g/mol
LogP0.60
Rot. Bonds10

About 1-[2-[2-(oxolan-2-ylmethoxy)ethoxy]ethoxy]propan-2-ol

1-[2-[2-(oxolan-2-ylmethoxy)ethoxy]ethoxy]propan-2-ol (PubChem CID 54459416) has the molecular formula C12H24O5 and a molecular weight of 248.32 g/mol. Its IUPAC name is 1-[2-[2-(oxolan-2-ylmethoxy)ethoxy]ethoxy]propan-2-ol.

Molecular Properties

Compound Name1-[2-[2-(oxolan-2-ylmethoxy)ethoxy]ethoxy]propan-2-ol
PubChem CID54459416
Molecular FormulaC12H24O5
Molecular Weight248.32 g/mol
Exact Mass248.16
IUPAC Name1-[2-[2-(oxolan-2-ylmethoxy)ethoxy]ethoxy]propan-2-ol
SMILESCC(O)COCCOCCOCC1CCCO1
InChIInChI=1S/C12H24O5/c1-11(13)9-15-7-5-14-6-8-16-10-12-3-2-4-17-12/h11-13H,2-10H2,1H3
InChIKeyXAOBGQDBHYONTB-UHFFFAOYSA-N
XLogP0.60
TPSA57.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.32
LogP ≤ 50.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-[2-(2-methoxyethoxy)ethoxymethyl]oxolane
CID 157159519
2-bromo-N-[3-(oxolan-2-ylmethoxy)propyl]propanamide
CID 107904862
2-[[(2R)-oxolan-2-yl]methoxy]ethylazanium
CID 7219875
1,1,3,3-tetramethyl-2-[3-(oxolan-2-ylmethoxy)propyl]guanidine
CID 111036016
N-(1-cyclopropylethyl)-3-(oxolan-2-ylmethoxy)propan-1-amine
CID 43205697
N-[2-(oxolan-2-ylmethoxy)ethyl]butan-2-amine
CID 62572646
2-[[(2R)-oxan-2-yl]methoxy]ethanol
CID 91298433
2-methyl-1-[2-(2-methylpropoxy)ethyl]-3-[3-(oxolan-2-ylmethoxy)propyl]guanidine;hydroiodide
CID 111408600
1-(diethylamino)-3-(oxolan-2-ylmethoxy)propan-2-ol
CID 110877523
1,1-difluoro-N-[3-(oxolan-2-ylmethoxy)propyl]propan-2-amine
CID 102868081
2-methylpropyl 2-(oxolan-2-ylmethoxy)acetate
CID 91155990
2-[5-(oxepan-2-ylmethoxy)pentoxymethyl]oxepane
CID 58879072

Frequently Asked Questions

What is the IUPAC name of 1-[2-[2-(oxolan-2-ylmethoxy)ethoxy]ethoxy]propan-2-ol?
The IUPAC name of 1-[2-[2-(oxolan-2-ylmethoxy)ethoxy]ethoxy]propan-2-ol (CID 54459416) is 1-[2-[2-(oxolan-2-ylmethoxy)ethoxy]ethoxy]propan-2-ol.
What is the SMILES notation for 1-[2-[2-(oxolan-2-ylmethoxy)ethoxy]ethoxy]propan-2-ol?
The canonical SMILES for 1-[2-[2-(oxolan-2-ylmethoxy)ethoxy]ethoxy]propan-2-ol is CC(O)COCCOCCOCC1CCCO1.
What is the InChIKey of 1-[2-[2-(oxolan-2-ylmethoxy)ethoxy]ethoxy]propan-2-ol?
The InChIKey is XAOBGQDBHYONTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24O5/c1-11(13)9-15-7-5-14-6-8-16-10-12-3-2-4-17-12/h11-13H,2-10H2,1H3.
What are the key properties of 1-[2-[2-(oxolan-2-ylmethoxy)ethoxy]ethoxy]propan-2-ol?
1-[2-[2-(oxolan-2-ylmethoxy)ethoxy]ethoxy]propan-2-ol has a molecular weight of 248.32 g/mol, XLogP of 0.60, 10 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[2-(oxolan-2-ylmethoxy)ethoxy]ethoxy]propan-2-ol is sourced from PubChem (CID 54459416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).