2-Methyl-3-heptanone
- Product Name2-Methyl-3-heptanone
- CAS13019-20-0
- MFC8H16O
- MW128.21
- EINECS235-877-0
- MOL File13019-20-0.mol
Chemical Properties
| Melting point | -32.24°C (estimate) |
| Boiling point | 158-160 °C (lit.) |
| Density | 0.816 g/mL at 25 °C (lit.) |
| FEMA | 4000 | 2-METHYLHEPTAN-3-ONE |
| refractive index | n |
| Flash point | 110 °F |
| storage temp. | 2-8°C, stored under nitrogen, away from moisture |
| form | clear liquid |
| color | Colorless to Almost colorless |
| Odor | at 100.00 %. fruity green leafy |
| Odor Type | fruity |
| JECFA Number | 1156 |
| InChI | InChI=1S/C8H16O/c1-4-5-6-8(9)7(2)3/h7H,4-6H2,1-3H3 |
| InChIKey | XYYMFUCZDNNGFS-UHFFFAOYSA-N |
| SMILES | CC(C)C(=O)CCCC |
| LogP | 2.32 |
| CAS DataBase Reference | 13019-20-0(CAS DataBase Reference) |
| EPA Substance Registry System | 3-Heptanone, 2-methyl- (13019-20-0) |
Safety Information
| Hazard Codes | Xi |
| Risk Statements | 10-36/37/38 |
| Safety Statements | 16-26-36/37/39 |
| RIDADR | UN 1224 3/PG 3 |
| WGK Germany | 3 |
| HazardClass | 3.2 |
| PackingGroup | III |
| HS Code | 29141900 |
| Storage Class | 3 - Flammable liquids |
| Hazard Classifications | Eye Irrit. 2 Flam. Liq. 3 Skin Irrit. 2 STOT SE 3 |