3,4,5-trimethoxy-2-(methoxymethyl)-6-methylideneoxane

C11H20O5 — CID 14679612

IUPAC3,4,5-trimethoxy-2-(methoxymethyl)-6-methylideneoxane
SMILESC=C1OC(COC)C(OC)C(OC)C1OC
InChIInChI=1S/C11H20O5/c1-7-9(13-3)11(15-5)10(14-4)8(16-7)6-12-2/h8-11H,1,6H2,2-5H3
InChIKeyONMVXTRLGKXWOV-UHFFFAOYSA-N
MW232.28 g/mol
LogP0.59
Rot. Bonds5

About 3,4,5-trimethoxy-2-(methoxymethyl)-6-methylideneoxane

3,4,5-trimethoxy-2-(methoxymethyl)-6-methylideneoxane (PubChem CID 14679612) has the molecular formula C11H20O5 and a molecular weight of 232.28 g/mol. Its IUPAC name is 3,4,5-trimethoxy-2-(methoxymethyl)-6-methylideneoxane.

Molecular Properties

Compound Name3,4,5-trimethoxy-2-(methoxymethyl)-6-methylideneoxane
PubChem CID14679612
Molecular FormulaC11H20O5
Molecular Weight232.28 g/mol
Exact Mass232.13
IUPAC Name3,4,5-trimethoxy-2-(methoxymethyl)-6-methylideneoxane
SMILESC=C1OC(COC)C(OC)C(OC)C1OC
InChIInChI=1S/C11H20O5/c1-7-9(13-3)11(15-5)10(14-4)8(16-7)6-12-2/h8-11H,1,6H2,2-5H3
InChIKeyONMVXTRLGKXWOV-UHFFFAOYSA-N
XLogP0.59
TPSA46.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.28
LogP ≤ 50.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

[(2R,3R,4S,5R)-3,4,5-triacetyloxy-6-methylideneoxan-2-yl]methyl acetate
CID 11290867
(2R,3R,4S,5R)-3,4,5-tris(methoxymethoxy)-2-(methoxymethoxymethyl)-6-methylideneoxane
CID 15489480
(3R)-3,4,5-tris(methoxymethoxy)-2-(methoxymethoxymethyl)-6-methylideneoxane
CID 68238096
(2R,3R,4R,5S)-3,5-dibutoxy-2-(butoxymethyl)-4-fluoro-6-methylideneoxane
CID 67522411
(2R,4S,5R)-3,4,5-tributoxy-2-(butoxymethyl)-6-(difluoromethylidene)oxane
CID 70793037
(2R,3S,4S,5R)-3,4,5-tributoxy-2-(butoxymethyl)-6-(difluoromethylidene)oxane
CID 70793073
(2R,3R,4S,5R)-3,4,5-tributoxy-2-(butoxymethyl)-6-(difluoromethylidene)oxane
CID 70793080
(3S,4S,5R)-3,4,5-tributoxy-2-(butoxymethyl)-6-(difluoromethylidene)oxane
CID 89431379
(3R,4S,5R,6R)-2-(difluoromethylidene)-3,4,5-trimethoxy-6-(methoxymethyl)oxane
CID 117663355
(2R,3S,4S,5R)-3,4,5-tributoxy-2-(butoxymethyl)-6-(fluoromethylidene)oxane
CID 173485143
(2R,3R,4S,5R)-3,4,5-tributoxy-2-(butoxymethyl)-6-(fluoromethylidene)oxane
CID 173503273
[(3R)-3,4,5-triacetyloxy-6-methylideneoxan-2-yl]methyl acetate
CID 135032976

Frequently Asked Questions

What is the IUPAC name of 3,4,5-trimethoxy-2-(methoxymethyl)-6-methylideneoxane?
The IUPAC name of 3,4,5-trimethoxy-2-(methoxymethyl)-6-methylideneoxane (CID 14679612) is 3,4,5-trimethoxy-2-(methoxymethyl)-6-methylideneoxane.
What is the SMILES notation for 3,4,5-trimethoxy-2-(methoxymethyl)-6-methylideneoxane?
The canonical SMILES for 3,4,5-trimethoxy-2-(methoxymethyl)-6-methylideneoxane is C=C1OC(COC)C(OC)C(OC)C1OC.
What is the InChIKey of 3,4,5-trimethoxy-2-(methoxymethyl)-6-methylideneoxane?
The InChIKey is ONMVXTRLGKXWOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O5/c1-7-9(13-3)11(15-5)10(14-4)8(16-7)6-12-2/h8-11H,1,6H2,2-5H3.
What are the key properties of 3,4,5-trimethoxy-2-(methoxymethyl)-6-methylideneoxane?
3,4,5-trimethoxy-2-(methoxymethyl)-6-methylideneoxane has a molecular weight of 232.28 g/mol, XLogP of 0.59, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4,5-trimethoxy-2-(methoxymethyl)-6-methylideneoxane is sourced from PubChem (CID 14679612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).