534-59-8
| Name | Butylmalonic acid |
| CAS | 534-59-8 |
| EINECS(EC#) | 208-602-7 |
| Molecular Formula | C7H12O4 |
| MDL Number | MFCD00002673 |
| Molecular Weight | 160.17 |
| MOL File | 534-59-8.mol |
Chemical Properties
| Appearance | WHITE CRYSTALLINE POWDER |
| Melting point | 105-107 °C (lit.) |
| Boiling point | 328.8°C (rough estimate) |
| density | 1.3681 (rough estimate) |
| refractive index | 1.4344 (estimate) |
| storage temp. | Sealed in dry,Room Temperature |
| form | powder to crystal |
| pka | pK (5°): 2.96 |
| color | White to Almost white |
| Water Solubility | 438g/L(25 ºC) |
| Merck | 13,1575 |
| InChI | 1S/C7H12O4/c1-2-3-4-5(6(8)9)7(10)11/h5H,2-4H2,1H3,(H,8,9)(H,10,11) |
| InChIKey | MCRZWYDXIGCFKO-UHFFFAOYSA-N |
| SMILES | CCCCC(C(O)=O)C(O)=O |
| CAS DataBase Reference | 534-59-8(CAS DataBase Reference) |
| NIST Chemistry Reference | Butylmalonic acid(534-59-8) |
Safety Data
| Symbol(GHS) |  GHS07 |
| Signal word | Warning |
| Hazard statements | H315-H319-H335 |
| Precautionary statements | P261-P264-P271-P280-P302+P352-P305+P351+P338 |
| Hazard Codes | Xi,Xn |
| Risk Statements | |
| Safety Statements | |
| WGK Germany | 3 |
| HS Code | 2917.19.7050 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |