Methylbernsteinsure
Bezeichnung:Methylbernsteinsure
CAS-Nr498-21-5
Englisch Name:2-Methylsuccinic acid
CBNumberCB9384875
SummenformelC5H8O4
Molgewicht132.11
MOL-Datei498-21-5.mol
Synonyma
Methylbernsteinsure
Methylbernsteinsure physikalisch-chemischer Eigenschaften
| Schmelzpunkt | 110-115 °C (lit.) |
| alpha | [α]D20 -1~+1° (c=5, C2H5OH) |
| Siedepunkt | 164.01°C (rough estimate) |
| Dichte | 1.0951 (rough estimate) |
| Brechungsindex | 1.4240 (estimate) |
| storage temp. | Sealed in dry,Room Temperature |
| Löslichkeit | Chloroform (Slightly), DMSO (Sparingly), Methanol (Slightly) |
| Aggregatzustand | Solid |
| pka | 4.13(at 25℃) |
| Farbe | White to Off-White |
| PH | 3.62(1 mM solution);3.08(10 mM solution);2.57(100 mM solution) |
| Wasserlöslichkeit | Soluble in water. |
| BRN | 1722946 |
| Stabilität | Stable. Combustible. Incompatible with bases, oxidizing agents, reducing agents. |
| InChI | 1S/C5H8O4/c1-3(5(8)9)2-4(6)7/h3H,2H2,1H3,(H,6,7)(H,8,9) |
| InChIKey | WXUAQHNMJWJLTG-UHFFFAOYSA-N |
| SMILES | CC(CC(O)=O)C(O)=O |
| CAS Datenbank | 498-21-5(CAS DataBase Reference) |
| Kennzeichnung gefährlicher | Xi |
| R-Sätze: | 36/37/38 |
| S-Sätze: | 26-36 |
| WGK Germany | 3 |
| TSCA | TSCA listed |
| HS Code | 29171900 |
| Speicherklasse | 11 - Combustible Solids |
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |

