Benzene-D6
ALDRICH/364940 - 99.6 atom % D, contains 0.03 % (v/v) TMS
Synonym: Hexadeuterobenzene
CAS Number: 1076-43-3
Empirical Formula (Hill Notation): C6D6
Molecular Weight: 84.15
EC Number: 214-061-8
MDL Number: MFCD00003010
Linear Formula: C6D6
Product Type: Chemical
| assay | 99% (CP) |
| bp | 79.1 °C/760 mmHg (lit.) |
| contains | 0.03 % (v/v) TMS |
| density | 0.950 g/mL at 25 °C (lit.) |
| expl. lim. | 0.34-6.3 % (lit.) |
| form | liquid |
| impurities | ≤0.0100% water water |
| InChI | 1S/C6H6/c1-2-4-6-5-3-1/h1 |
| InChI key | UHOVQNZJYSORNB-MZWXYZOWSA |
| isotopic purity | 99.6 atom % D |
| mass shift | M+6 |
| mp | 6.8 °C (lit.) |
| refractive index | n |
| SMILES string | [2H]c1c([2H])c([2H])c([2H |
| technique(s) | NMR: suitable |
| Application: | Benzene-d6 (C6D6) may be used in the following: • Synthesis of isotopically labeled samples. • As a 1H and 13C-NMR solvent. • In the internal calibration of benzene stock solution. |
| General description: | Benzene-d6 (C6D6) is deuterated benzene. Its Soret coefficient S(T) has been measured by transient holographic grating technique. Its synthesis,13C NMR, IR and MS spectra have been reported. |
| Packaging: | 10 g in ampule |
| Packaging: | 25, 50 g in glass bottle |
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| Symbol |    GHS02,GHS07,GHS08 |
| Signal word | Danger |
| Hazard statements | H225 - H304 - H315 - H319 - H340 - H350 - H372 - H412 |
| Precautionary statements | P210 - P273 - P301 + P310 - P303 + P361 + P353 - P305 + P351 + P338 - P331 |
| Hazard Codes | F,T |
| Risk Statements | 45-46-11-36/38-48/23/24/25-65 |
| Safety Statements | 53-45 |
| RIDADR | UN1114 - class 3 - PG 2 - Benzene, solution |
| WGK Germany | WGK 3 |
| Flash Point(F) | 12.2 °F - closed cup |
| Flash Point(C) | -11 °C - closed cup |
| Purity | 99% (CP) |
| bp | 79.1 °C/760 mmHg (lit.) |
| mp | 6.8 °C (lit.) |
| Density | 0.950 g/mL at 25 °C (lit.) |
| Refractive Index | n |
| UNSPSC | 12142201 |