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Molecule
Phenyl Glycidyl Ether
CAS: 122-60-1 · C9H10O2
2D Structure
3D Structure
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Basic Information
- CAS Registry Number
- 122-60-1
- Molecular Formula
- C9H10O2
- Molecular Mass
- 150.18 g/mol
Identifiers
CAS Registry Number
122-60-1
SMILES
c1ccc(OCC2CO2)cc1
InChI Key
FQYUMYWMJTYZTK-UHFFFAOYSA-N
InChI
InChI=1S/C9H10O2/c1-2-4-8(5-3-1)10-6-9-7-11-9/h1-5,9H,6-7H2
Names and Synonyms
- Phenyl Glycidyl Ether Synonym
- (Phenoxymethyl)oxirane Synonym
- 2,3-Epoxy-1-phenoxypropane Synonym
- 2,3-Epoxypropoxybenzene Synonym
- 3-Phenoxy-1-propene oxide Synonym
- Oxiranylmethyl phenyl ether Synonym
- 3-Phenoxypropylene oxide Synonym
- (±)-Phenyl glycidyl ether Synonym
- (±)-1,2-Epoxy-3-phenoxypropane Synonym
- (±)-(Phenoxymethyl)oxirane Synonym
- (±)-Glycidyl phenyl ether Synonym
- Denacol EX 141 Synonym
- Heloxy 63 Synonym
- Heloxy Modifier 63 Synonym
- NSC 53476 Synonym
- NSC 635 Synonym
- PGE-H Synonym
- Epoxy 690 Synonym
- (Phenyloxymethyl)oxirane Synonym
- EX 141 Synonym
- Epiol P Synonym
- K 103 Synonym
- YS 690 Synonym
- JX 016 Synonym
- O-Phenylglycidol Synonym
- 3-(Phenoxy)propylene epoxide Synonym
- Diluent 690 Synonym
- Beihe CGE Synonym
- XY 690 Synonym
- G 830179 Synonym
- Oxirane, 2-(phenoxymethyl)- Synonym
- Propane, 1,2-epoxy-3-phenoxy- Synonym
- Oxirane, (phenoxymethyl)- Synonym
- 2-(Phenoxymethyl)oxirane Synonym
- 1,2-Epoxy-3-phenoxypropane Synonym
- Glycidyl phenyl ether Synonym
- Phenol glycidyl ether Synonym
- Phenyl 2,3-epoxypropyl ether Synonym
- Phenyl glycidyl ether Synonym
- 3-Phenoxy-1,2-epoxypropane Synonym
- 3-Phenoxy-1,2-propylene oxide Synonym
- γ-Phenoxypropylene oxide Synonym
- 1-Phenoxy-2,3-epoxypropane Synonym
- 2,3-Epoxypropyl phenyl ether Synonym
- Glycidol phenyl ether Synonym
- 3-(Phenyloxy)-1,2-epoxypropane Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 150.18 g/mol | CAS Common Chemistry |
| 150.177 g/mol | RDKit | |
| Density | 1.11 g/cm³ | CAS Common Chemistry |
| 1.1092 g/cm3 | CAS Common Chemistry | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Phenyl_glycidyl_ether | CAS Common Chemistry |
| Canonical SMILES | O(C=1C=CC=CC1)CC2OC2 | CAS Common Chemistry |
| InChI | InChI=1S/C9H10O2/c1-2-4-8(5-3-1)10-6-9-7-11-9/h1-5,9H,6-7H2 | CAS Common Chemistry |
| InChI Key | InChIKey=FQYUMYWMJTYZTK-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 3.5 °C | CAS Common Chemistry |
| Name | Phenyl glycidyl ether | CAS Common Chemistry |
| Heavy Atom Count | 11 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 3 | RDKit |
| Aromatic Ring Count | 1 | RDKit |
| Topological Polar Surface Area | 21.759999999999998 Ų | RDKit |
| 21.76 Ų | RDKit | |
| LogP | 1.4641999999999997 | RDKit |
| 1.4642 | RDKit | |
| Molar Refractivity | 41.67700000000003 cm³/mol | RDKit |
| Ring Count | 2 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.3333 | RDKit |
| 0.33 | chempirical lib | |
| Exact Mass | 150.06807956 g/mol | RDKit |
| Boiling Point | 245 °C @ 760 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
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Quick conversion
MW = 150.18 g/mol; density = 1.110 g/mL. Edit any field — others recompute live.
Related
Related molecules
Other compounds with formula C9H10O2.
