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Hydroquinone Bis(2-Hydroxyethyl) Ether
CAS: 104-38-1 | C10H14O4
2D Structure
3D Structure
Loading 3D structure...
Basic Information
- CAS Registry Number
- 104-38-1
- Molecular Formula
- C10H14O4
- Molecular Mass
- 198.22 g/mol
Identifiers
CAS Registry Number
104-38-1
SMILES
OCCOc1ccc(OCCO)cc1
InChI Key
WTPYFJNYAMXZJG-UHFFFAOYSA-N
InChI
InChI=1S/C10H14O4/c11-5-7-13-9-1-2-10(4-3-9)14-8-6-12/h1-4,11-12H,5-8H2
Names and Synonyms
- Hydroquinone Bis(2-Hydroxyethyl) Ether Common Name
- Ethanol, 2,2′-[1,4-phenylenebis(oxy)]bis- Synonym
- Ethanol, 2,2′-(p-phenylenedioxy)di- Synonym
- 2,2′-[1,4-Phenylenebis(oxy)]bis[ethanol] Synonym
- Hydroquinone bis(2-hydroxyethyl) ether Synonym
- 1,4-Bis(2-hydroxyethoxy)benzene Synonym
- 1,4-Bis(β-hydroxyethoxy)benzene Synonym
- 2,2′-(p-Phenylenedioxy)diethanol Synonym
- p-Phenylene bis(β-hydroxyethyl ether) Synonym
- 2,2′-(Phenylenedioxy)diethanol Synonym
- Hydroquinone diethylol ether Synonym
- Hydroquinone bis(β-hydroxyethyl) ether Synonym
- Bis(β-hydroxyethyl) hydroquinone ether Synonym
- Vernatzer 30/10 Synonym
- Hydroquinone di(2-hydroxyethyl ether) Synonym
- 1,4-(2-Hydroxyethoxy)benzene Synonym
- Thanecure HQ Synonym
- HQ 20 Synonym
- NSC 1862 Synonym
- NSC 26611 Synonym
- 1,4-Bis(2′-hydroxyethoxy)benzene Synonym
- Poly-G HQEE Synonym
- HQ 2 Synonym
- 1,4-Di(2-hydroxyethoxy)benzene Synonym
- p-Di(2-hydroxyethoxy)benzene Synonym
- Hydroquinone dihydroxyethyl ether Synonym
- 2-[4-(2-Hydroxyethoxy)phenoxy]ethanol Synonym
- Addolink 30/10 Synonym
- Hydroquinone bis(2-hydroxylethyl) ether Synonym
- HQEE Synonym
- 1,4-Di(2-hydroxyethyloxy)benzene Synonym
- 1,4-Bis(2-hydroxyethyloxy)benzene Synonym
- 1,4-Di-(β-hydroxyethyl)-hydroquinone Synonym
- Hardener 30/10 Synonym
- 2-[4-(2-Hydroxyethoxy)phenoxy]ethan-1-ol Synonym
All Properties
Comprehensive physical and chemical properties
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 198.22 g/mol | CAS Common Chemistry |
| 198.21799999999996 g/mol | RDKit | |
| 198.218 g/mol | RDKit | |
| Canonical SMILES | OCCOC1=CC=C(OCCO)C=C1 | CAS Common Chemistry |
| InChI | InChI=1S/C10H14O4/c11-5-7-13-9-1-2-10(4-3-9)14-8-6-12/h1-4,11-12H,5-8H2 | CAS Common Chemistry |
| InChI Key | InChIKey=WTPYFJNYAMXZJG-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 96-97 °C | CAS Common Chemistry |
| Name | Hydroquinone bis(2-hydroxyethyl) ether | CAS Common Chemistry |
| Heavy Atom Count | 14 | RDKit |
| Hydrogen Bond Acceptors | 4 | RDKit |
| Hydrogen Bond Donors | 2 | RDKit |
| Rotatable Bonds | 6 | RDKit |
| Aromatic Ring Count | 1 | RDKit |
| Topological Polar Surface Area | 58.92 Ų | RDKit |
| LogP | 0.4287999999999999 | RDKit |
| 0.4288 | RDKit | |
| Molar Refractivity | 51.603600000000036 cm³/mol | RDKit |
| Ring Count | 1 | RDKit |
| Formal Charge | 0 | RDKit |
| Fraction Csp3 | 0.4 | RDKit |
| Exact Mass | 198.089208928 g/mol | RDKit |
Spectral Data
NMR, IR, and Mass spectral data
Predicting NMR spectra...
10 ppm
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2
1
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200 ppm
180
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140
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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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