Cyclohexane-d12
ALDRICH/151866 - ≥99.6 atom % D
CAS Number: 1735-17-7
Empirical Formula (Hill Notation): C6D12
Molecular Weight: 96.23
EC Number: 217-077-3
MDL Number: MFCD00044212
Linear Formula: C6D12
Product Type: Chemical
| assay | ≥99% (CP) |
| bp | 80.7 °C (lit.) |
| density | 0.893 g/mL at 25 °C (lit.) |
| expl. lim. | 0.34-6.3 % (lit.) |
| form | liquid |
| InChI | 1S/C6H12/c1-2-4-6-5-3-1/h |
| InChI key | XDTMQSROBMDMFD-LBTWDOQPSA |
| isotopic purity | ≥99.6 atom % D |
| mass shift | M+12 |
| mp | 6.5 °C (lit.) |
| Quality Level | 200  |
| refractive index | n |
| SMILES string | [2H]C1([2H])C([2H])([2H]) |
| technique(s) | NMR: suitable |
| General description: | Cyclohexane-d12, a deuterated cyclohexane, is a standard purity solvent useful for routine NMR (Nuclear Magnetic Resonance) studies. Its infrared (vapor and liquid phase in the range of 376-4000cm-1) and Raman (liquid phase) spectral investigations have been reported. Ring inversion of cyclohexane-d12 has been studied by recording its deuterium NMR spectrum in the temperature range -36 to +115°C. It can be prepared by reacting benzene-d6 and deuterium. |
| Packaging: | 1, 5, 10 g in ampule |
| Packaging: | 10×1 mL in ampule |
| Symbol |     GHS02,GHS07,GHS08,GHS09 |
| Signal word | Danger |
| Hazard statements | H225 - H304 - H315 - H336 - H410 |
| Precautionary statements | P210 - P261 - P273 - P301 + P310 - P331 - P501 |
| Hazard Codes | F,Xn,N |
| Risk Statements | 11-38-50/53-65-67 |
| Safety Statements | 9-16-25-33-60-61-62 |
| RIDADR | UN1145 - class 3 - PG 2 - Cyclohexane |
| WGK Germany | WGK 3 |
| Flash Point(F) | -0.4 °F - closed cup |
| Flash Point(C) | -18 °C - closed cup |
| Purity | ≥99% (CP) |
| bp | 80.7 °C (lit.) |
| mp | 6.5 °C (lit.) |
| Density | 0.893 g/mL at 25 °C (lit.) |
| Refractive Index | n |
| UNSPSC | 12142201 |