diisopropyl oxalate
chelating agents
| 2D: |
 |
| 3D: |
|
| CAS Number: |
615-81-6
|
| ECHA EC Number: |
210-448-0 |
| FDA UNII: |
Search |
| Category: |
chelating agents |
| IUPAC Name: |
diisopropyl oxalate |
| InChI : |
InChI=1/C8H14O4/c1-5(2)11-7(9)8(10)12-6(3)4/h5-6H,1-4H3 |
| Std.InChI: |
InChI=1S/C8H14O4/c1-5(2)11-7(9)8(10)12-6(3)4/h5-6H,1-4H3 |
| InChIKey : |
ITHNIFCFNUZYLQ-UHFFFAOYAJ |
| Std.InChIKey: |
ITHNIFCFNUZYLQ-UHFFFAOYSA-N |
| SMILES : |
CC(C)OC(=O)C(=O)OC(C)C |
| Molar Refractivity : |
42.57 ± 0.3 cm3 (est) |
| Parachor : |
394.6 ± 4.0 cm3 (est) |
| Index of Refraction : |
1.419 ± 0.02 (est) |
| Surface Tension : |
30.2 ± 3.0 dyne/cm (est) |
| Density : |
1.034 ± 0.06 g/cm3 (est) |
| Polarizability : |
16.87 ± 0.5 10-24cm3 (est) |
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Physical Properties:
| Appearance: | colorless to pale yellow clear liquid (est) |
| Assay: | 95.00 to 100.00 |
| Food Chemicals Codex Listed: | No |
| Boiling Point: | 191.00 °C. @ 760.00 mm Hg |
| Vapor Pressure: | 0.339000 mmHg @ 25.00 °C. (est) |
| Flash Point: | 167.00 °F. TCC ( 75.30 °C. ) (est) |
| logP (o/w): | 1.412 (est) |
| Soluble in: |
| | alcohol |
| | water, 5128 mg/L @ 25 °C (est) |
| Insoluble in: |
| | water |
Safety Information:
| |
| Hazards identification |
| |
| Classification of the substance or mixture |
| GHS Classification in accordance with 29 CFR 1910 (OSHA HCS) |
| None found. |
| GHS Label elements, including precautionary statements |
| |
| Pictogram | |
| |
| Hazard statement(s) |
| None found. |
| Precautionary statement(s) |
| None found. |
| Oral/Parenteral Toxicity: |
| Not determined |
| Dermal Toxicity: |
| Not determined |
| Inhalation Toxicity: |
| Not determined |
Safety in Use Information:
| Category: |
| chelating agents |
| Recommendation for diisopropyl oxalate usage levels up to: |
| | not for fragrance use. |
| |
| Recommendation for diisopropyl oxalate flavor usage levels up to: |
| | not for flavor use. |
Potential Blenders and core components :
Occurrence (nature, food, other):
Synonyms:
| | diisopropyloxalate |
| | dipropan-2-yl oxalate |
| | ethanedioic acid bis(1-methylethyl) ester |
| | ethanedioic acid, bis(1-methylethyl) ester |
