2,4-Dimethyl-3-pentanone
ALDRICH/136867 - 98%
Synonym: Diisopropyl ketone; Isobutyrone
CAS Number: 565-80-0
Empirical Formula (Hill Notation): C7H14O
Molecular Weight: 114.19
EC Number: 209-294-7
MDL Number: MFCD00008918
Linear Formula: (CH3)2CHCOCH(CH3)2
Product Type: Chemical
This picture is provided solely for illustration purposes. Optical properties of the actual product may deviate. Relevant product information is printed on labeled products and other accompanying or available information material. This image depicts SKU: 136867-100ML.
This picture is provided solely for illustration purposes. Optical properties of the actual product may deviate. Relevant product information is printed on labeled products and other accompanying or available information material. This image depicts SKU: 136867-500ML.
| assay | 98% |
| bp | 124 °C (lit.) |
| density | 0.806 g/mL at 25 °C (lit.) |
| form | liquid |
| InChI | 1S/C7H14O/c1-5(2)7(8)6(3) |
| InChI key | HXVNBWAKAOHACI-UHFFFAOYSA |
| mp | −80 °C (lit.) |
| Quality Level | 100  |
| refractive index | n |
| SMILES string | CC(C)C(=O)C(C)C |
| Application: | 2,4-Dimethyl-3-pentanone was used in an experimental method to measure the equilibrium isotopic fractionation factor (αeq ) for C-bound H positions adjacent to carbonyl group in ketones. |
| Packaging: | 100, 500 mL in glass bottle |
| Symbol |   GHS02,GHS07 |
| Signal word | Danger |
| Hazard statements | H225 - H332 |
| Precautionary statements | P210 - P233 - P240 - P241 - P242 - P304 + P340 + P312 |
| Hazard Codes | F,Xn |
| Risk Statements | 11-20 |
| Safety Statements | 9-16-24/25 |
| RIDADR | UN1224 - class 3 - PG 2 - VP > 110kPa - Ketones, liquid, n.o.s., |
| WGK Germany | WGK 1 |
| Flash Point(F) | 59.0 °F - closed cup |
| Flash Point(C) | 15 °C - closed cup |
| Purity | 98% |
| bp | 124 °C (lit.) |
| mp | −80 °C (lit.) |
| Density | 0.806 g/mL at 25 °C (lit.) |
| Refractive Index | n |
| UNSPSC | 12352100 |