Back to Search
Molecule
4-Methoxyphenyl Glycidyl Ether
CAS: 2211-94-1 · C10H12O3
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 2211-94-1
- Molecular Formula
- C10H12O3
- Molecular Mass
- 180.20 g/mol
Identifiers
CAS Registry Number
2211-94-1
SMILES
COc1ccc(OCC2CO2)cc1
InChI Key
AVWGFHZLPMLKBL-UHFFFAOYSA-N
InChI
InChI=1S/C10H12O3/c1-11-8-2-4-9(5-3-8)12-6-10-7-13-10/h2-5,10H,6-7H2,1H3
Names and Synonyms
- 4-Methoxyphenyl Glycidyl Ether Systematic Name
- Oxirane, 2-[(4-methoxyphenoxy)methyl]- Synonym
- Benzene, 1-(2,3-epoxypropoxy)-4-methoxy- Synonym
- Oxirane, [(4-methoxyphenoxy)methyl]- Synonym
- 2-[(4-Methoxyphenoxy)methyl]oxirane Synonym
- 3-(4-Methoxyphenoxy)-1,2-epoxypropane Synonym
- 1-(p-Methoxyphenoxy)-2,3-epoxypropane Synonym
- p-Methoxyphenyl glycidyl ether Synonym
- Glycidyl p-methoxyphenyl ether Synonym
- 1,2-Epoxy-3-(p-methoxyphenoxy)propane Synonym
- Glycidyl 4-methoxyphenyl ether Synonym
- 2-(p-Methoxyphenoxymethyl)oxirane Synonym
- 1-(4-Methoxyphenoxy)-2,3-epoxypropane Synonym
- 2,3-Epoxypropyl p-methoxyphenyl ether Synonym
- 1,2-Epoxy-3-(4-methoxyphenoxy)propane Synonym
- 1-(2,3-Epoxypropoxy)-4-methoxybenzene Synonym
- (4-Methoxyphenoxymethyl)oxirane Synonym
- (±)-O-(4-Methoxyphenyl)glycidol Synonym
- 2,3-Epoxypropyl 4-methoxyphenyl ether Synonym
- 4-Methoxyphenyl glycidyl ether Synonym
- NSC 126709 Synonym
- NSC 26796 Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 180.20 g/mol | CAS Common Chemistry |
| 180.20299999999997 g/mol | RDKit | |
| 180.203 g/mol | RDKit | |
| Canonical SMILES | O(C1=CC=C(OCC2OC2)C=C1)C | CAS Common Chemistry |
| InChI | InChI=1S/C10H12O3/c1-11-8-2-4-9(5-3-8)12-6-10-7-13-10/h2-5,10H,6-7H2,1H3 | CAS Common Chemistry |
| InChI Key | InChIKey=AVWGFHZLPMLKBL-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 48 °C | CAS Common Chemistry |
| Name | 4-Methoxyphenyl glycidyl ether | CAS Common Chemistry |
| Heavy Atom Count | 13 | RDKit |
| Hydrogen Bond Acceptors | 3 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 4 | RDKit |
| Aromatic Ring Count | 1 | RDKit |
| Topological Polar Surface Area | 30.990000000000002 Ų | RDKit |
| 30.99 Ų | RDKit | |
| LogP | 1.4727999999999999 | RDKit |
| 1.4728 | RDKit | |
| Molar Refractivity | 48.22900000000003 cm³/mol | RDKit |
| Ring Count | 2 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.4 | RDKit |
| Exact Mass | 180.078644244 g/mol | RDKit |
| Boiling Point | 135-137 °C @ 2.5 Torr | CAS Common Chemistry |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
External Resources
Convert
Quick conversion
MW = 180.20 g/mol. Edit any field — others recompute live.
Related
Related molecules
Other compounds with formula C10H12O3.
