3-Heptanone
SIAL/90046 - analytical standard
Synonym: Butyl ethyl ketone; Ethyl butyl ketone
CAS Number: 106-35-4
Empirical Formula (Hill Notation): C7H14O
Molecular Weight: 114.19
EC Number: 203-388-1
MDL Number: MFCD00009483
Linear Formula: CH3(CH2)3COC2H5
Product Type: Chemical
| application(s) | cleaning products cosmetics flavors and fragrances food and beverages personal care |
| assay | ≥98.5% (GC) |
| bp | 146-149 °C (lit.) |
| density | 0.818 g/mL at 25 °C (lit.) |
| format | neat |
| grade | analytical standard |
| impurities | ≤0.3% water |
| InChI | 1S/C7H14O/c1-3-5-6-7(8)4- |
| InChI key | NGAZZOYFWWSOGK-UHFFFAOYSA |
| mp | −39 °C (lit.) |
| Quality Level | 100  |
| refractive index | n |
| n |
|
| shelf life | limited shelf life, expiry date on the label |
| SMILES string | CCCCC(=O)CC |
| technique(s) | gas chromatography (GC): suitable |
| HPLC: suitable |
| Application: | Refer to the product′s Certificate of Analysis for more information on a suitable instrument technique. Contact Technical Service for further support. |
| Symbol |   GHS02,GHS07 |
| Signal word | Warning |
| Hazard statements | H226 - H315 - H319 - H332 |
| Precautionary statements | P210 - P233 - P240 - P303 + P361 + P353 - P304 + P340 + P312 - P305 + P351 + P338 |
| Hazard Codes | Xn |
| Risk Statements | 10-20-36 |
| Safety Statements | 24 |
| RIDADR | UN1224 - class 3 - PG 3 - Ketones, liquid, n.o.s., HI: all |
| WGK Germany | WGK 2 |
| Flash Point(F) | 100.4 °F - closed cup |
| Flash Point(C) | 38 °C - closed cup |
| Purity | ≥98.5% (GC) |
| bp | 146-149 °C (lit.) |
| mp | −39 °C (lit.) |
| Density | 0.818 g/mL at 25 °C (lit.) |
| Refractive Index | n |
| UNSPSC | 85151701 |