3,6-dimethoxy-2-methyloxane;ethane

C10H22O3 — CID 145337988

IUPAC3,6-dimethoxy-2-methyloxane;ethane
SMILESCC.COC1CCC(OC)C(C)O1
InChIInChI=1S/C8H16O3.C2H6/c1-6-7(9-2)4-5-8(10-3)11-6;1-2/h6-8H,4-5H2,1-3H3;1-2H3
InChIKeyBHEXMIYGIIMXFV-UHFFFAOYSA-N
MW190.28 g/mol
LogP2.20
Rot. Bonds2

About 3,6-dimethoxy-2-methyloxane;ethane

3,6-dimethoxy-2-methyloxane;ethane (PubChem CID 145337988) has the molecular formula C10H22O3 and a molecular weight of 190.28 g/mol. Its IUPAC name is 3,6-dimethoxy-2-methyloxane;ethane.

Molecular Properties

Compound Name3,6-dimethoxy-2-methyloxane;ethane
PubChem CID145337988
Molecular FormulaC10H22O3
Molecular Weight190.28 g/mol
Exact Mass190.16
IUPAC Name3,6-dimethoxy-2-methyloxane;ethane
SMILESCC.COC1CCC(OC)C(C)O1
InChIInChI=1S/C8H16O3.C2H6/c1-6-7(9-2)4-5-8(10-3)11-6;1-2/h6-8H,4-5H2,1-3H3;1-2H3
InChIKeyBHEXMIYGIIMXFV-UHFFFAOYSA-N
XLogP2.20
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.28
LogP ≤ 52.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(2S,3S,6R)-6-methoxy-2-methyloxan-3-amine
CID 55284490
(2R)-6-methoxy-2-methyloxan-3-ol
CID 145387170
(5R)-2-methoxy-5-methyloxolane
CID 70228275
(2S,5R)-2-methoxy-5-[(2R,5S)-5-methoxyoxolan-2-yl]oxolane
CID 71424305
(2S,3R,6R)-6-methoxy-2-methyloxan-3-amine;propane-2,2-diol
CID 176998974
6-methoxy-2-methyloxan-3-one
CID 13011795
ethane;(2R,3R,6R)-3-methoxy-6-methyloxan-2-ol
CID 144590904
(3S)-3,4,5-trimethoxy-2,6-dimethyloxane
CID 129044476
5-methoxy-2-methyloxolan-3-amine
CID 163994899
(2R,3R)-2,3-dimethoxy-6-methyloxane
CID 143625377
(2R,3R,5R,6S)-2,3,5-trimethoxy-6-methyloxane
CID 88978646
(2R,3R,4R,6S)-6-[(2R,3R,4S,6S)-4,6-dimethoxy-2-methyloxan-3-yl]oxy-4-methoxy-2-methyloxan-3-ol
CID 162926783

Frequently Asked Questions

What is the IUPAC name of 3,6-dimethoxy-2-methyloxane;ethane?
The IUPAC name of 3,6-dimethoxy-2-methyloxane;ethane (CID 145337988) is 3,6-dimethoxy-2-methyloxane;ethane.
What is the SMILES notation for 3,6-dimethoxy-2-methyloxane;ethane?
The canonical SMILES for 3,6-dimethoxy-2-methyloxane;ethane is CC.COC1CCC(OC)C(C)O1.
What is the InChIKey of 3,6-dimethoxy-2-methyloxane;ethane?
The InChIKey is BHEXMIYGIIMXFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16O3.C2H6/c1-6-7(9-2)4-5-8(10-3)11-6;1-2/h6-8H,4-5H2,1-3H3;1-2H3.
What are the key properties of 3,6-dimethoxy-2-methyloxane;ethane?
3,6-dimethoxy-2-methyloxane;ethane has a molecular weight of 190.28 g/mol, XLogP of 2.20, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,6-dimethoxy-2-methyloxane;ethane is sourced from PubChem (CID 145337988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).