5-(ethoxymethyl)-2,2-dimethyloxolane

C9H18O2 — CID 20754038

IUPAC5-(ethoxymethyl)-2,2-dimethyloxolane
SMILESCCOCC1CCC(C)(C)O1
InChIInChI=1S/C9H18O2/c1-4-10-7-8-5-6-9(2,3)11-8/h8H,4-7H2,1-3H3
InChIKeyABXJBNGDEWQSSS-UHFFFAOYSA-N
MW158.24 g/mol
LogP1.98
Rot. Bonds3

About 5-(ethoxymethyl)-2,2-dimethyloxolane

5-(ethoxymethyl)-2,2-dimethyloxolane (PubChem CID 20754038) has the molecular formula C9H18O2 and a molecular weight of 158.24 g/mol. Its IUPAC name is 5-(ethoxymethyl)-2,2-dimethyloxolane.

Molecular Properties

Compound Name5-(ethoxymethyl)-2,2-dimethyloxolane
PubChem CID20754038
Molecular FormulaC9H18O2
Molecular Weight158.24 g/mol
Exact Mass158.13
IUPAC Name5-(ethoxymethyl)-2,2-dimethyloxolane
SMILESCCOCC1CCC(C)(C)O1
InChIInChI=1S/C9H18O2/c1-4-10-7-8-5-6-9(2,3)11-8/h8H,4-7H2,1-3H3
InChIKeyABXJBNGDEWQSSS-UHFFFAOYSA-N
XLogP1.98
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.24
LogP ≤ 51.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(2S,3R,5R)-3-fluoro-2-methyl-4-[(2-methylpropan-2-yl)oxy]-5-[(2-methylpropan-2-yl)oxymethyl]oxolane
CID 159890248
(2S,3S,5R)-3-fluoro-2-methyl-4-[(2-methylpropan-2-yl)oxy]-5-[(2-methylpropan-2-yl)oxymethyl]oxolane
CID 159890249
(2S,3R,5S)-3-fluoro-5-(methoxymethyl)-2,3-dimethyloxolane
CID 170263418
2-(1-Ethoxyethyl)oxolane
CID 53952097
2,5-Bis(ethoxymethyl)oxolane
CID 67974178
2-(1-Butoxyethyl)oxolane
CID 68102942
2-(Butoxymethyl)-5-methyloxolane
CID 77157020
2-(4-Methyloxolan-2-yl)propan-2-ol
CID 117829470
(2R,5S)-2,5-bis(methoxymethyl)oxolane
CID 118171219
(2S)-2,5-bis(methoxymethyl)oxolane
CID 132229211
4-Ethyl-2-(methoxymethyl)oxolane
CID 140191131
tributyl-[(2S,3S,5R)-5-[(1S)-1-methoxyethyl]-3-methyloxolan-2-yl]stannane
CID 11590114

Frequently Asked Questions

What is the IUPAC name of 5-(ethoxymethyl)-2,2-dimethyloxolane?
The IUPAC name of 5-(ethoxymethyl)-2,2-dimethyloxolane (CID 20754038) is 5-(ethoxymethyl)-2,2-dimethyloxolane.
What is the SMILES notation for 5-(ethoxymethyl)-2,2-dimethyloxolane?
The canonical SMILES for 5-(ethoxymethyl)-2,2-dimethyloxolane is CCOCC1CCC(C)(C)O1.
What is the InChIKey of 5-(ethoxymethyl)-2,2-dimethyloxolane?
The InChIKey is ABXJBNGDEWQSSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18O2/c1-4-10-7-8-5-6-9(2,3)11-8/h8H,4-7H2,1-3H3.
What are the key properties of 5-(ethoxymethyl)-2,2-dimethyloxolane?
5-(ethoxymethyl)-2,2-dimethyloxolane has a molecular weight of 158.24 g/mol, XLogP of 1.98, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(ethoxymethyl)-2,2-dimethyloxolane is sourced from PubChem (CID 20754038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).