3-Methyl-2-butanone
SIGALD/59600 - puriss., ≥98.5% (GC)
Synonym: Isopropyl methyl ketone; Methyl isopropyl ketone
CAS Number: 563-80-4
Empirical Formula (Hill Notation): C5H10O
Molecular Weight: 86.13
EC Number: 209-264-3
MDL Number: MFCD00008919
Linear Formula: (CH3)2CHCOCH3
Product Type: Chemical
assay | ≥98.5% (GC) |
bp | 94-95 °C (lit.) |
density | 0.805 g/mL at 25 °C (lit.) |
expl. lim. | 0.34-6.3 % |
form | liquid |
grade | puriss. |
InChI | 1S/C5H10O/c1-4(2)5(3)6/h4 |
InChI key | SYBYTAAJFKOIEJ-UHFFFAOYSA |
mp | −92 °C (lit.) |
Quality Level | 200 |
refractive index | n |
n |
|
SMILES string | CC(C)C(C)=O |
solubility | water: soluble(lit.) |
Application: | 3-Methyl-2-butanone (Isopropyl methyl ketone, Methyl isopropyl ketone) may be used for the asymmetric synthesis of (R)-3-methyl-2-butanol by Wool-Pd complex catalyzed hydrogenation reaction. |
Symbol | GHS02 |
Signal word | Danger |
Hazard statements | H225 |
Precautionary statements | P210 - P233 - P240 - P241 - P242 - P243 |
Hazard Codes | F |
Risk Statements | 11-67 |
Safety Statements | 9-16-33 |
RIDADR | UN 2397 3 / PGII |
WGK Germany | WGK 1 |
Flash Point(F) | 30.2 °F |
Flash Point(C) | -1 °C |
Purity | ≥98.5% (GC) |
bp | 94-95 °C (lit.) |
mp | −92 °C (lit.) |
Density | 0.805 g/mL at 25 °C (lit.) |
Refractive Index | n |
UNSPSC | 12352115 |