2-(methoxymethyl)-3,4,5-trimethyloxolane

C9H18O2 — CID 21349670

IUPAC2-(methoxymethyl)-3,4,5-trimethyloxolane
SMILESCOCC1OC(C)C(C)C1C
InChIInChI=1S/C9H18O2/c1-6-7(2)9(5-10-4)11-8(6)3/h6-9H,5H2,1-4H3
InChIKeyXQMLREYHDMAELA-UHFFFAOYSA-N
MW158.24 g/mol
LogP1.69
Rot. Bonds2

About 2-(methoxymethyl)-3,4,5-trimethyloxolane

2-(methoxymethyl)-3,4,5-trimethyloxolane (PubChem CID 21349670) has the molecular formula C9H18O2 and a molecular weight of 158.24 g/mol. Its IUPAC name is 2-(methoxymethyl)-3,4,5-trimethyloxolane.

Molecular Properties

Compound Name2-(methoxymethyl)-3,4,5-trimethyloxolane
PubChem CID21349670
Molecular FormulaC9H18O2
Molecular Weight158.24 g/mol
Exact Mass158.13
IUPAC Name2-(methoxymethyl)-3,4,5-trimethyloxolane
SMILESCOCC1OC(C)C(C)C1C
InChIInChI=1S/C9H18O2/c1-6-7(2)9(5-10-4)11-8(6)3/h6-9H,5H2,1-4H3
InChIKeyXQMLREYHDMAELA-UHFFFAOYSA-N
XLogP1.69
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.24
LogP ≤ 51.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(3R,5S,6S)-3-methoxy-2-(methoxymethyl)-4,5,6-trimethyloxane
CID 71166951
(2R,4R,5R)-3,4-dimethoxy-2-(methoxymethyl)-5-methyloxolane
CID 174068913
(2S,3S)-2-ethyl-3,4,5-trimethyloxolane
CID 59088156
(2S,3R,4S,5S,6R)-2-ethyl-3,4,5,6-tetramethyloxane
CID 59944457
(3S,4R,6S)-2-ethyl-3,4,5,6-tetramethyloxane
CID 91273556
(3S,6S)-2-ethyl-3,4,5,6-tetramethyloxane
CID 91456258
(3R,4S,6S)-2-ethyl-3,4,5,6-tetramethyloxane
CID 90919001
(2R,4S,5R)-2,3,4-trimethoxy-6-(methoxymethyl)-5-methyloxane
CID 176646378
[(3S,4R,6S)-3,4,5,6-tetramethyloxan-2-yl]methanol
CID 157375693
[(2S,3S,4R,5S,6R)-3,4,5,6-tetramethyloxan-2-yl]methanol
CID 163662814
2-ethyl-3-methoxy-4,5,6-trimethyloxane
CID 20632118
(3S,5S,6R)-2-ethyl-3-methoxy-4,5,6-trimethyloxane
CID 159477864

Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethyl)-3,4,5-trimethyloxolane?
The IUPAC name of 2-(methoxymethyl)-3,4,5-trimethyloxolane (CID 21349670) is 2-(methoxymethyl)-3,4,5-trimethyloxolane.
What is the SMILES notation for 2-(methoxymethyl)-3,4,5-trimethyloxolane?
The canonical SMILES for 2-(methoxymethyl)-3,4,5-trimethyloxolane is COCC1OC(C)C(C)C1C.
What is the InChIKey of 2-(methoxymethyl)-3,4,5-trimethyloxolane?
The InChIKey is XQMLREYHDMAELA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18O2/c1-6-7(2)9(5-10-4)11-8(6)3/h6-9H,5H2,1-4H3.
What are the key properties of 2-(methoxymethyl)-3,4,5-trimethyloxolane?
2-(methoxymethyl)-3,4,5-trimethyloxolane has a molecular weight of 158.24 g/mol, XLogP of 1.69, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)-3,4,5-trimethyloxolane is sourced from PubChem (CID 21349670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).