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Cas Database |
| Name |
Butyl glycolate |
EINECS | 230-991-7 |
| CAS No. | 7397-62-8 | Density | 1.027 g/cm3 |
| PSA | 46.53000 | LogP | 0.32200 |
| Solubility | 46g/L at 20℃ | Melting Point |
-26ºC |
| Formula | C6H12O3 | Boiling Point | 183 °C at 760 mmHg |
| Molecular Weight | 132.159 | Flash Point | 71.7 °C |
| Transport Information | N/A | Appearance | clear liquid |
| Safety | 23-24/25 | Risk Codes | 63-41 |
| Molecular Structure |
|
Hazard Symbols | Xn |
| Synonyms |
Aceticacid, hydroxy-, butyl ester (9CI);Glycolic acid, butyl ester (6CI,7CI,8CI);Butoxycarbonylmethanol;Butyl hydroxyacetate;Polysolvan O;n-Butyl glycolate; |
Article Data | 20 |
Butyl glycolate Synthetic route
| Conditions | Yield |
|---|---|
| Stage #1: formaldehyd; carbon monoxide With 1,3,5-Trioxan; formic acid; sulfuric acid In 1,4-dioxane; dichloromethane at 120℃; under 67506.8 Torr; Stage #2: butan-1-ol In 1,4-dioxane; dichloromethane at 160℃; under 18001.8 Torr; for 40h; | 98.3% |
| Conditions | Yield |
|---|---|
| With ion exchange at 120℃; pH=2; pH-value; Temperature; Reagent/catalyst; | 92% |
| With toluene-4-sulfonic acid In cyclohexane for 5h; Reflux; | 85.1% |
| With sulfuric acid; benzene bei langsamer Destillation; |
| Conditions | Yield |
|---|---|
| stannous octoate In hexanoic acid at 135℃; |
| Conditions | Yield |
|---|---|
| With toluene-4-sulfonic acid In cyclohexane for 5h; Reflux; | A n/a B 85.1% |
| Conditions | Yield |
|---|---|
| With sulfuric acid; water at 210 - 260℃; under 588406 - 661957 Torr; CO-Druck; |
| Conditions | Yield |
|---|---|
| With triethylamine for 1h; Heating; Inert atmosphere; Ionic liquid; | 87% |
| Conditions | Yield |
|---|---|
| With zeolite MFI-ATSn for 6h; Reagent/catalyst; Time; Sealed tube; Green chemistry; | 53% |
| Conditions | Yield |
|---|---|
| unter Entfernen des entstehenden Wassers und Ammoniaks; |
- 7397-62-8
butyl glycolate
- 327-92-4
1,5-difluoro-2,4-dinitrobenzene
- 122641-49-0
butyl 2,4-dinitro-5-fluorophenoxyacetate
| Conditions | Yield |
|---|---|
| With triethylamine In 1,2-dichloro-ethane at 0 - 5℃; for 2h; Large scale; | 89.9% |
Butyl glycolate Chemical Properties
IUPAC Name: Butyl 2-hydroxyacetate
Following is the structure of Acetic acid,2-hydroxy-, butyl ester (CAS NO.7397-62-8):
Empirical Formula: C6H12O3
Molecular Weight: 132.1577
EINECS: 230-991-7
Index of Refraction: 1.429
Molar Refractivity: 33.15 cm3
Molar Volume: 128.5 cm3
Density: 1.027 g/cm3
Flash Point: 71.7 °C
Surface Tension: 34.8 dyne/cm
Enthalpy of Vaporization: 48.8 kJ/mol
Boiling Point: 183 °C at 760 mmHg
Appearance of Acetic acid,2-hydroxy-, butyl ester (CAS NO.7397-62-8): clear liquid
Vapour Pressure of Acetic acid,2-hydroxy-, butyl ester (CAS NO.7397-62-8): 0.227 mmHg at 25 °C
Canonical SMILES: CCCCOC(=O)CO
InChI: InChI=1S/C6H12O3/c1-2-3-4-9-6(8)5-7/h7H,2-5H2,1H3
InChIKey: VFGRALUHHHDIQI-UHFFFAOYSA-N
Butyl glycolate Safety Profile
Safety Statements: 23-24/25
S23:Do not breathe vapour.
S24/25:Avoid contact with skin and eyes.
WGK Germany: 1
Butyl glycolate Specification
Acetic acid,2-hydroxy-, butyl ester , its cas register number 7397-62-8. It also can be called Polysolvan 0 ; Butyl glycolate ; and Butyl hydroxyacetate .
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