| Identification | More | [Name]
3,5-Dimethyl-4-hydroxybenzonitrile | [CAS]
4198-90-7 | [Synonyms]
2,6-DIMETHYL-4-CYANOPHENOL
3,5-DIMETHYL-4-HYDROXYBENZONITRILE
4-CYANO-2,6-DIMETHYLPHENOL
4-CYANO-2,6-DIMETHYLPHENOLE
4-HYDROXY-3,5-DIMETHYLBENZONITRILE
TIMTEC-BB SBB005819
3,5-dimethyl-4-hydroxy-benzonitril
4-Hydroxy-3,5-Dimethylbenzonit
3, 5 DIMETHYL-4-HYDROXYBENZONITRILE,98% | [EINECS(EC#)]
452-810-2 | [Molecular Formula]
C9H9NO | [MDL Number]
MFCD00221716 | [Molecular Weight]
147.17 | [MOL File]
4198-90-7.mol |
| Chemical Properties | Back Directory | [Appearance]
White to beige crystalline powder | [Melting point ]
123-127 °C | [Boiling point ]
267.28°C (rough estimate) | [density ]
1.1135 (rough estimate) | [vapor pressure ]
0.005Pa at 25℃ | [refractive index ]
1.5290 (estimate) | [storage temp. ]
Inert atmosphere,Room Temperature | [solubility ]
soluble in Methanol | [form ]
Crystalline Powder | [pka]
pK1:8.27 (25°C) | [color ]
White to beige | [Water Solubility ]
320mg/L at 20℃ | [InChIKey]
WFYGXOWFEIOHCZ-UHFFFAOYSA-N | [LogP]
1.6 at 20℃ | [CAS DataBase Reference]
4198-90-7(CAS DataBase Reference) |
| Safety Data | Back Directory | [Hazard Codes ]
T,Xn,Xi | [Risk Statements ]
R25:Toxic if swallowed.
R36:Irritating to the eyes.
R32:Contact with acids liberates very toxic gas.
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
R36/37/38:Irritating to eyes, respiratory system and skin . | [Safety Statements ]
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
S36/37:Wear suitable protective clothing and gloves . | [RIDADR ]
UN 2811 6.1/PG 3
| [WGK Germany ]
3 | [RTECS ]
DI4359000
| [Hazard Note ]
Toxic | [HazardClass ]
IRRITANT | [HS Code ]
29269095 | [Toxicity]
mouse,LD50,intraperitoneal,650mg/kg (650mg/kg),Journal of Medicinal and Pharmaceutical Chemistry. Vol. 2, Pg. 201, 1960. |
| Hazard Information | Back Directory | [Chemical Properties]
White to beige crystalline powder | [Uses]
Intermediate in the preparation of HIV replication inhibitors. | [Definition]
ChEBI: 4-Hydroxy-3,5-dimethylbenzonitrile is a hydroxytoluene. | [Flammability and Explosibility]
Notclassified |
|
|