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Diglycidyl Resorcinol Ether
CAS: 101-90-6 | C12H14O4
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
101-90-6
Molecular Formula:
C12H14O4
Molecular Mass:
222.24 g/mol
Names and Synonyms:
Diglycidyl Resorcinol Ether
Oxirane, 2,2′-[1,3-phenylenebis(oxymethylene)]bis-
Benzene, m-bis(2,3-epoxypropoxy)-
2,2′-[1,3-Phenylenebis(oxymethylene)]bis[oxirane]
m-Bis(2,3-epoxypropoxy)benzene
Resorcinol diglycidyl ether
Diglycidyl resorcinol ether
Resorcinol glycidyl ether
Resorcinol bis(2,3-epoxypropyl) ether
1,3-Bis(2,3-epoxypropoxy)benzene
m-Bis(glycidyloxy)benzene
NSC 76621
1,3-Diglycidyloxybenzene
1,3-Dihydroxybenzene diglycidyl ether
2-[3-(Oxiran-2-ylmethoxy)phenoxymethyl]oxirane
2-[[3-(Oxiran-2-ylmethoxy)phenoxy]methyl]oxirane
KMC 694
Identifiers:
SMILES:
c1cc(OCC2CO2)cc(OCC2CO2)c1
InChI:
InChI=1S/C12H14O4/c1-2-9(13-5-11-7-15-11)4-10(3-1)14-6-12-8-16-12/h1-4,11-12H,5-8H2
Key Properties
Boiling Point
172 °C @ Press: 0.8 Torr
CAS Common Chemistry
Melting Point
32-33 °C
CAS Common Chemistry
Density
1.21 g/cm³
CAS Common Chemistry
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
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.
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 222.24 g/mol | CAS Common Chemistry |
| 222.23999999999995 g/mol | RDKit | |
| 222.089208928 g/mol | RDKit | |
| Density | 1.21 g/cm³ | CAS Common Chemistry |
| 1.21 g/cm3 @ Temp: 25 °C | CAS Common Chemistry | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Diglycidyl_resorcinol_ether | CAS Common Chemistry |
| Boiling Point | 172 °C @ Press: 0.8 Torr | CAS Common Chemistry |
| Canonical SMILES | O(C1=CC=CC(OCC2OC2)=C1)CC3OC3 | CAS Common Chemistry |
| InChI | InChI=1S/C12H14O4/c1-2-9(13-5-11-7-15-11)4-10(3-1)14-6-12-8-16-12/h1-4,11-12H,5-8H2 | CAS Common Chemistry |
| InChI Key | InChIKey=WPYCRFCQABTEKC-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 32-33 °C | CAS Common Chemistry |
| Name | Resorcinol diglycidyl ether | CAS Common Chemistry |
| Diglycidyl resorcinol ether | CAS Common Chemistry | |
| Heavy Atom Count | 16 | RDKit |
| Hydrogen Bond Acceptors | 4 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 6 | RDKit |
| Aromatic Ring Count | 1 | RDKit |
| Topological Polar Surface Area | 43.519999999999996 Ų | RDKit |
| LogP | 1.2417999999999998 | RDKit |
| Molar Refractivity | 56.91200000000004 | RDKit |
