3-(2-methoxyethoxymethoxy)-2H-furan-5-one

C8H12O5 — CID 11206248

IUPAC3-(2-methoxyethoxymethoxy)-2H-furan-5-one
SMILESCOCCOCOC1=CC(=O)OC1
InChIInChI=1S/C8H12O5/c1-10-2-3-11-6-13-7-4-8(9)12-5-7/h4H,2-3,5-6H2,1H3
InChIKeyICRSKHAWONEBBL-UHFFFAOYSA-N
MW188.18 g/mol
LogP0.06
Rot. Bonds6

About 3-(2-methoxyethoxymethoxy)-2H-furan-5-one

3-(2-methoxyethoxymethoxy)-2H-furan-5-one (PubChem CID 11206248) has the molecular formula C8H12O5 and a molecular weight of 188.18 g/mol. Its IUPAC name is 3-(2-methoxyethoxymethoxy)-2H-furan-5-one.

Molecular Properties

Compound Name3-(2-methoxyethoxymethoxy)-2H-furan-5-one
PubChem CID11206248
Molecular FormulaC8H12O5
Molecular Weight188.18 g/mol
Exact Mass188.07
IUPAC Name3-(2-methoxyethoxymethoxy)-2H-furan-5-one
SMILESCOCCOCOC1=CC(=O)OC1
InChIInChI=1S/C8H12O5/c1-10-2-3-11-6-13-7-4-8(9)12-5-7/h4H,2-3,5-6H2,1H3
InChIKeyICRSKHAWONEBBL-UHFFFAOYSA-N
XLogP0.06
TPSA53.99 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.18
LogP ≤ 50.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

(r,s)-4,5-Dimethoxy-5h-furan-2-one
CID 12615322
(3-methoxy-5-oxo-2H-furan-2-yl) acetate
CID 12886070
(r,s)-5-Butoxy-4-methoxy-5h-furan-2-one
CID 85535216
(r,s)-5-Allyloxy-4-methoxy-5h-furan-2-one
CID 85535218
4-ethoxy-2(5H)-furanone
CID 10866347
5-Oxo-2,5-dihydrofuran-3-yl acetate
CID 12565887
4-Propoxyfuran-2(5H)-one
CID 13987376
(3-Acetyloxy-2,5-dihydrofuran-2-yl) acetate
CID 54078206
Ethyl 2,2,5-trimethyl-1,3-dioxole-4-carboxylate
CID 13528602
(5Z)-4-methoxy-3-(methoxymethoxy)-5-[2-(methoxymethoxy)ethylidene]furan-2-one
CID 14351110
tert-butyl (Z)-3-(1,4-dioxan-2-yloxy)but-2-enoate
CID 121015288
propan-2-yl (Z)-3-(1,4-dioxan-2-yloxy)but-2-enoate
CID 121222390

Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyethoxymethoxy)-2H-furan-5-one?
The IUPAC name of 3-(2-methoxyethoxymethoxy)-2H-furan-5-one (CID 11206248) is 3-(2-methoxyethoxymethoxy)-2H-furan-5-one.
What is the SMILES notation for 3-(2-methoxyethoxymethoxy)-2H-furan-5-one?
The canonical SMILES for 3-(2-methoxyethoxymethoxy)-2H-furan-5-one is COCCOCOC1=CC(=O)OC1.
What is the InChIKey of 3-(2-methoxyethoxymethoxy)-2H-furan-5-one?
The InChIKey is ICRSKHAWONEBBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12O5/c1-10-2-3-11-6-13-7-4-8(9)12-5-7/h4H,2-3,5-6H2,1H3.
What are the key properties of 3-(2-methoxyethoxymethoxy)-2H-furan-5-one?
3-(2-methoxyethoxymethoxy)-2H-furan-5-one has a molecular weight of 188.18 g/mol, XLogP of 0.06, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyethoxymethoxy)-2H-furan-5-one is sourced from PubChem (CID 11206248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).