Name | Phenol-d6 |
Synonyms | Phenol-d6 PHENOL-D6(SUR) hexadeuterophenol Hexadeuteriophenol Phen-2,3,4,5,6-d5-ol-d |
CAS | 13127-88-3 |
EINECS | 236-063-8 |
InChI | InChI=1/C6H6O/c7-6-4-2-1-3-5-6/h1-5,7H/i1D,2D,3D,4D,5D/hD |
InChIKey | ISWSIDIOOBJBQZ-QNKSCLMFSA-N |
Molecular Formula | C6D6O |
Molar Mass | 100.15 |
Density | 1.140 g/mL at 25 °C |
Melting Point | 40-42 °C (lit.) |
Boling Point | 182 °C (lit.) |
Flash Point | 175°F |
Solubility | 84g/l |
Vapor Presure | 0.36 mm Hg ( 20 °C) |
Vapor Density | 3.24 (vs air) |
Appearance | Solid Mass (Deliquescent) |
BRN | 2255089 |
PH | 5 (50g/l, H2O, 20℃) |
Storage Condition | 2-8°C |
Stability | Stable. Incompatible with strong acids, strong bases, strong oxidizing agents. |
Explosive Limit | 1.3-9.5%(V) |
Refractive Index | 1.553 |
Risk Codes | R23/24/25 - Toxic by inhalation, in contact with skin and if swallowed. R34 - Causes burns R48/20/21/22 - R68 - Possible risk of irreversible effects R40 - Limited evidence of a carcinogenic effect |
Safety Description | S24/25 - Avoid contact with skin and eyes. S26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S28 - After contact with skin, wash immediately with plenty of soap-suds. S36/37/39 - Wear suitable protective clothing, gloves and eye/face protection. S45 - In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.) S36/37 - Wear suitable protective clothing and gloves. |
UN IDs | UN 1671 6.1/PG 2 |
WGK Germany | 2 |
FLUKA BRAND F CODES | 3-8-10-23 |
HS Code | 28459000 |
Hazard Class | 6.1(a) |
Packing Group | II |
EPA chemical substance information | information provided by: ofmpeb.epa.gov (external link) |
Use | phenol-D6 is a deuterated phenol that can be used as an internal standard or for the preparation of stable isotope labeled P-Hydroxybenzoic acid. |
preparation | Yamamoto et al. reported that phenol-d6 can be catalyzed by phenol at PtO2, 250°C, 4 MPa under the reaction with heavy water. |
autoignition temperature | 1319 ° F. |