| Identification | More | [Name]
4-(1H-1,2,4-Triazol-1-ylmethyl)benzonitrile | [CAS]
112809-25-3 | [Synonyms]
4-(1H-1,2,4-TRIAZOL-1-YLMETHYL)BENZONITRILE
4-(1H-1,2,4-TRIAZOLYLMETHYL)BENZONITRILE
4-[1-(1,2,4-triazolyl)-methyl-benzonitrile
4-1-(1,2,4-Triazolyl)-methyl-benzonitril
4-((1H-1,2,4-triazol-1-yl)methyl)benzonitrile (intermediate of letrozole)
4-(1H-1,2,4-Triazol-1-ylmethyl)benzonitrile 97%
4-[1-(4-CYANOPHENYL)-HYDROXYMETHYL]-BENZONITRILE
INTERMEDIATE OF LETROZOLE
4-[1-(1,2,4-triazolyl)-methyl]-benzonitrile ( For Letrozole )
Benzonitrile, 4-(1H-1,2,4-triazol-1-ylmethyl)- | [Molecular Formula]
C10H8N4 | [MDL Number]
MFCD07368016 | [Molecular Weight]
184.2 | [MOL File]
112809-25-3.mol |
| Chemical Properties | Back Directory | [Appearance]
White Solid | [Melting point ]
69 °C | [Boiling point ]
412.1±55.0 °C(Predicted) | [density ]
1.19±0.1 g/cm3(Predicted) | [storage temp. ]
Sealed in dry,2-8°C | [solubility ]
Chloroform (Slightly), Methanol (Slightly) | [form ]
Solid | [pka]
2.52±0.10(Predicted) | [color ]
White | [InChI]
InChI=1S/C10H8N4/c11-5-9-1-3-10(4-2-9)6-14-8-12-7-13-14/h1-4,7-8H,6H2 | [InChIKey]
HQLYWHSJALKYOV-UHFFFAOYSA-N | [SMILES]
C(#N)C1=CC=C(CN2C=NC=N2)C=C1 | [CAS DataBase Reference]
112809-25-3(CAS DataBase Reference) |
| Safety Data | Back Directory | [Hazard Codes ]
Xn | [Risk Statements ]
R10:Flammable.
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed . | [Safety Statements ]
S16:Keep away from sources of ignition-No smoking .
S22:Do not breathe dust .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection . | [HS Code ]
2933998090 |
| Hazard Information | Back Directory | [Chemical Properties]
White Solid | [Uses]
4-(1H-1,2,4-Triazol-1-ylmethyl)benzonitrile is an intermediate in the synthesis of Letrozole (L330100), an antineoplastic. |
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