2,6-dipropoxyoxane

C11H22O3 — CID 524398

IUPAC2,6-dipropoxyoxane
SMILESCCCOC1CCCC(OCCC)O1
InChIInChI=1S/C11H22O3/c1-3-8-12-10-6-5-7-11(14-10)13-9-4-2/h10-11H,3-9H2,1-2H3
InChIKeyVFFAGSFTJRWPGJ-UHFFFAOYSA-N
MW202.29 g/mol
LogP2.69
Rot. Bonds6

About 2,6-dipropoxyoxane

2,6-dipropoxyoxane (PubChem CID 524398) has the molecular formula C11H22O3 and a molecular weight of 202.29 g/mol. Its IUPAC name is 2,6-dipropoxyoxane.

Molecular Properties

Compound Name2,6-dipropoxyoxane
PubChem CID524398
Molecular FormulaC11H22O3
Molecular Weight202.29 g/mol
Exact Mass202.16
IUPAC Name2,6-dipropoxyoxane
SMILESCCCOC1CCCC(OCCC)O1
InChIInChI=1S/C11H22O3/c1-3-8-12-10-6-5-7-11(14-10)13-9-4-2/h10-11H,3-9H2,1-2H3
InChIKeyVFFAGSFTJRWPGJ-UHFFFAOYSA-N
XLogP2.69
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.29
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-decoxy-6-methyloxane
CID 160930984
2,4-dimethyl-6-propoxy-1,3-dioxane
CID 89315667
5-propoxy-1,4-dioxepane
CID 10964801
propoxycyclooctane
CID 54078990
trimethyl-[methyl-bis(4-propoxyoxetan-2-yl)silyl]oxysilane
CID 141087141
2-octacosoxyoxane
CID 11214102
6-pentoxyoxan-2-one
CID 70139952
5-propoxycyclooctene
CID 77387390
[(2S)-6-(2-aminoethoxy)oxan-2-yl]methanol
CID 163533140
3-chloro-5-(6-methoxyoxan-2-yl)oxypentanoic acid
CID 57157934
2-(hydroxymethyl)-6-propoxyoxane-3,4-diol
CID 154980808
2-[2-(oxan-2-yloxy)ethoxy]ethanol;2-(2-propoxyethoxy)oxane
CID 160999917

Frequently Asked Questions

What is the IUPAC name of 2,6-dipropoxyoxane?
The IUPAC name of 2,6-dipropoxyoxane (CID 524398) is 2,6-dipropoxyoxane.
What is the SMILES notation for 2,6-dipropoxyoxane?
The canonical SMILES for 2,6-dipropoxyoxane is CCCOC1CCCC(OCCC)O1.
What is the InChIKey of 2,6-dipropoxyoxane?
The InChIKey is VFFAGSFTJRWPGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O3/c1-3-8-12-10-6-5-7-11(14-10)13-9-4-2/h10-11H,3-9H2,1-2H3.
What are the key properties of 2,6-dipropoxyoxane?
2,6-dipropoxyoxane has a molecular weight of 202.29 g/mol, XLogP of 2.69, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dipropoxyoxane is sourced from PubChem (CID 524398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).