(2R,5S)-2,5-bis(methoxymethyl)oxolane

C8H16O3 — CID 118171219

IUPAC(2R,5S)-2,5-bis(methoxymethyl)oxolane
SMILESCOC[C@H]1CC[C@@H](COC)O1
InChIInChI=1S/C8H16O3/c1-9-5-7-3-4-8(11-7)6-10-2/h7-8H,3-6H2,1-2H3/t7-,8+
InChIKeyFRBJEDLSFZZCFY-OCAPTIKFSA-N
MW160.21 g/mol
LogP0.83
Rot. Bonds4

About (2R,5S)-2,5-bis(methoxymethyl)oxolane

(2R,5S)-2,5-bis(methoxymethyl)oxolane (PubChem CID 118171219) has the molecular formula C8H16O3 and a molecular weight of 160.21 g/mol. Its IUPAC name is (2R,5S)-2,5-bis(methoxymethyl)oxolane.

Molecular Properties

Compound Name(2R,5S)-2,5-bis(methoxymethyl)oxolane
PubChem CID118171219
Molecular FormulaC8H16O3
Molecular Weight160.21 g/mol
Exact Mass160.11
IUPAC Name(2R,5S)-2,5-bis(methoxymethyl)oxolane
SMILESCOC[C@H]1CC[C@@H](COC)O1
InChIInChI=1S/C8H16O3/c1-9-5-7-3-4-8(11-7)6-10-2/h7-8H,3-6H2,1-2H3/t7-,8+
InChIKeyFRBJEDLSFZZCFY-OCAPTIKFSA-N
XLogP0.83
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.21
LogP ≤ 50.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(Butoxymethyl)tetrahydrofuran
CID 4581212
1,2,6-Trimethoxyhexane
CID 551374
Tetrahydrofurfuryl isopropyl ether
CID 13763952
2,5-Anhydro-1,3,4,6-tetra-O-methyl-D-glucitol
CID 288212
1-Methoxy-5-butoxyhexane
CID 13262441
(2S,3S,4R,5R)-3-(2-fluoroethoxy)-2-methyl-4-propan-2-yloxy-5-(propan-2-yloxymethyl)oxolane
CID 58062016
(2R,4R,5S)-4-fluoro-3-methoxy-2-(methoxymethyl)-5-methyloxolane
CID 58209642
(2S,3S,4R,5R)-3-fluoro-2-methyl-4-propan-2-yloxy-5-[(1S)-1-propan-2-yloxyethyl]oxolane
CID 58498310
(2S,4R,5R)-3-(2-fluoroethoxy)-2-methyl-4-propan-2-yloxy-5-(propan-2-yloxymethyl)oxolane
CID 58566890
(2S,3R,5R)-3-fluoro-2-methyl-4-propan-2-yloxy-5-(propan-2-yloxymethyl)oxolane
CID 59475268
(2R,3S,5S)-4-fluoro-3-methoxy-2-(methoxymethyl)-5-methyloxolane
CID 60040892
(2R,3S,5S)-3-fluoro-4-methoxy-2-(methoxymethyl)-5-methyloxolane
CID 60040893

Frequently Asked Questions

What is the IUPAC name of (2R,5S)-2,5-bis(methoxymethyl)oxolane?
The IUPAC name of (2R,5S)-2,5-bis(methoxymethyl)oxolane (CID 118171219) is (2R,5S)-2,5-bis(methoxymethyl)oxolane.
What is the SMILES notation for (2R,5S)-2,5-bis(methoxymethyl)oxolane?
The canonical SMILES for (2R,5S)-2,5-bis(methoxymethyl)oxolane is COC[C@H]1CC[C@@H](COC)O1.
What is the InChIKey of (2R,5S)-2,5-bis(methoxymethyl)oxolane?
The InChIKey is FRBJEDLSFZZCFY-OCAPTIKFSA-N. The full InChI is InChI=1S/C8H16O3/c1-9-5-7-3-4-8(11-7)6-10-2/h7-8H,3-6H2,1-2H3/t7-,8+.
What are the key properties of (2R,5S)-2,5-bis(methoxymethyl)oxolane?
(2R,5S)-2,5-bis(methoxymethyl)oxolane has a molecular weight of 160.21 g/mol, XLogP of 0.83, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,5S)-2,5-bis(methoxymethyl)oxolane is sourced from PubChem (CID 118171219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).