Hexyl chloroformate
SIAL/67389 - for GC derivatization, LiChropur™, ≥97.0% (GC)
CAS Number: 6092-54-2
Empirical Formula (Hill Notation): C7H13ClO2
Molecular Weight: 164.63
EC Number: 228-036-4
MDL Number: MFCD00000651
Linear Formula: ClCO2(CH2)5CH3
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: 67389-1ML-KC
| assay | ≥97.0% (GC) |
| bp | 60-61 °C/7 mmHg (lit.) |
| density | 1.007 g/mL at 25 °C (lit.) |
| grade | for GC derivatization |
| InChI | 1S/C7H13ClO2/c1-2-3-4-5-6 |
| InChI key | KIWBRXCOTCXSSZ-UHFFFAOYSA |
| quality | LiChropur™ |
| Quality Level | 100  |
| reaction suitability | reagent type: derivatization reagent reaction type: Acylations |
| refractive index | n |
| SMILES string | CCCCCCOC(Cl)=O |
| storage temp. | 2-8°C |
| technique(s) | gas chromatography (GC): suitable |
| vapor pressure | 0.06 psi ( 20 °C) |
| Application: | Hexyl chloroformate may be used as a derivatizing reagent for the quantification of antiepileptic drugs, cathinones, amphetamine-like stimulants and other new psychoactive substances in biological samples using gas chromatography coupled to mass spectrometry (GC-MS). |
| General description: | Hexyl chloroformate belongs to the class of chloroformates. It is widely used in the derivatization of highly hydrophilic compounds to hexyl esters, carbonates and carbamates. |
| Legal Information: | LiChropur is a trademark of Merck KGaA, Darmstadt, Germany |
| Recommended products: | Discover LiChropur™ reagents ideal for HPLC or LC-MS analysis |
| Symbol |   GHS05,GHS06 |
| Signal word | Danger |
| Hazard statements | H301 + H311 + H331 - H314 |
| Precautionary statements | P261 - P270 - P280 - P303 + P361 + P353 - P304 + P340 + P310 - P305 + P351 + P338 |
| Hazard Codes | T |
| Risk Statements | 23/24/25-34 |
| Safety Statements | 26-27-36/37/39-45 |
| RIDADR | UN 3277 8(6.1) / PGII |
| WGK Germany | WGK 3 |
| Flash Point(F) | 143.6 °F - closed cup |
| Flash Point(C) | 62 °C - closed cup |
| Purity | ≥97.0% (GC) |
| bp | 60-61 °C/7 mmHg (lit.) |
| Density | 1.007 g/mL at 25 °C (lit.) |
| Refractive Index | n |
| Storage Temp. | 2-8°C |
| UNSPSC | 12000000 |