4839-46-7
3,3-Dimethylglutaric acid
CAS: 4839-46-7
Molecular Formula: C7H12O4
4839-46-7 - Names and Identifiers
| Name | 3,3-Dimethylglutaric acid |
| Synonyms | 3,3-Dimethylglutaric acid 3,3-DIMETHYLGLUTARIC ACID 3,3-dimethylpentanedioate 3,3-dimethyl-pentanedioicaci Glutaric acid, 3,3-dimethyl- 3,3-DIMETHYLPENTANEDOIC ACID 3,3-DIMETHYLPENTANEDIOIC ACID 3,3-Dimethylpentanedioic acid Pentanedioic acid, 3,3-dimethyl- 2,2-Dimethylpropane-1,3-dicarboxylic acid 2,2-DIMETHYLPROPANE-1,3-DICARBOXYLIC ACID 2,2-O-DIMETHYLPROPANE-1,3-DICARBOXYLIC ACID |
| CAS | 4839-46-7 |
| EINECS | 225-425-0 |
| InChI | InChI=1/C7H12O4/c1-7(2,3-5(8)9)4-6(10)11/h3-4H2,1-2H3,(H,8,9)(H,10,11)/p-2 |
| InChIKey | DUHQIGLHYXLKAE-UHFFFAOYSA-N |
4839-46-7 - Physico-chemical Properties
| Molecular Formula | C7H12O4 |
| Molar Mass | 160.17 |
| Density | 1,42 g/cm3 |
| Melting Point | 100-102 °C (lit.) |
| Boling Point | 290 °C |
| Flash Point | 89-90°C/2mm |
| Water Solubility | soluble |
| Solubility | Chloroform (Slightly), Methanol (Slightly) |
| Vapor Presure | 0.000264mmHg at 25°C |
| Appearance | White powder |
| Color | White to beige |
| BRN | 1765439 |
| pKa | pK1:3.70;pK2:6.34 (25°C) |
| Storage Condition | Sealed in dry,Room Temperature |
| Refractive Index | 1.4336 (estimate) |
| MDL | MFCD00002716 |
4839-46-7 - Risk and Safety
| Hazard Symbols | Xi - Irritant |
| Risk Codes | 36/37/38 - Irritating to eyes, respiratory system and skin. |
| Safety Description | S26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S36 - Wear suitable protective clothing. |
| WGK Germany | 3 |
| TSCA | Yes |
| HS Code | 29171990 |
4839-46-7 - Reference Information
| NIST chemical information | Information provided by: webbook.nist.gov (external link) |
| EPA chemical information | Information provided by: ofmpub.epa.gov (external link) |
| Biological activity | 3,3-Dimethylglutaric acid (3,3-Dimethylpentanedioate) is a compound occasionally found in human urine. |
Last Update：2024-04-09 21:04:16
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