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Molecule
2-[(2-Oxiranylmethoxy)Methyl]Furan
CAS: 5380-87-0 · C8H10O3
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 5380-87-0
- Molecular Formula
- C8H10O3
- Molecular Mass
- 154.17 g/mol
Identifiers
CAS Registry Number
5380-87-0
SMILES
c1coc(COCC2CO2)c1
InChI Key
RUGWIVARLJMKDM-UHFFFAOYSA-N
InChI
InChI=1S/C8H10O3/c1-2-7(10-3-1)4-9-5-8-6-11-8/h1-3,8H,4-6H2
Names and Synonyms
- 2-[(2-Oxiranylmethoxy)Methyl]Furan Synonym
- Furan, 2-[(2-oxiranylmethoxy)methyl]- Synonym
- Furan, 2-[(2,3-epoxypropoxy)methyl]- Synonym
- Furan, 2-[(oxiranylmethoxy)methyl]- Synonym
- 2-[(2-Oxiranylmethoxy)methyl]furan Synonym
- Furfuryl glycidyl ether Synonym
- 2-[(2,3-Epoxypropoxy)methyl]furan Synonym
- 2-((Furan-2-ylmethyl)oxymethyl)oxirane Synonym
- Glycidyl furfuryl ether Synonym
- 2-(Glycidyloxymethyl)furan Synonym
- 2-Furylmethyl glycidyl ether Synonym
- 2-Oxiranylmethoxymethyl-furan Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 154.17 g/mol | CAS Common Chemistry |
| 154.165 g/mol | RDKit | |
| Density | 1.15 g/cm³ | CAS Common Chemistry |
| 1.1452 g/cm3 @ 20 °C | CAS Common Chemistry | |
| Canonical SMILES | O1C=CC=C1COCC2OC2 | CAS Common Chemistry |
| InChI | InChI=1S/C8H10O3/c1-2-7(10-3-1)4-9-5-8-6-11-8/h1-3,8H,4-6H2 | CAS Common Chemistry |
| InChI Key | InChIKey=RUGWIVARLJMKDM-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | 2-[(2-Oxiranylmethoxy)methyl]furan | CAS Common Chemistry |
| Heavy Atom Count | 11 | RDKit |
| Hydrogen Bond Acceptors | 3 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 4 | RDKit |
| Aromatic Ring Count | 1 | RDKit |
| Topological Polar Surface Area | 34.9 Ų | RDKit |
| LogP | 1.195 | RDKit |
| Molar Refractivity | 38.104000000000006 cm³/mol | RDKit |
| Ring Count | 2 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.5 | RDKit |
| Exact Mass | 154.06299418 g/mol | RDKit |
| Boiling Point | 85.5-87 °C @ 1.5 Torr | CAS Common Chemistry |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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1
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| Shift (ppm) | Multiplicity | Integration | Assignment |
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200 ppm
180
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20
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| Shift (ppm) | DEPT | Assignment |
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Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
External Resources
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MW = 154.17 g/mol; density = 1.150 g/mL. Edit any field — others recompute live.
Related
Related molecules
Other compounds with formula C8H10O3.
