Home Categories 4-((1H-1,2,4-Triazol-1-yl)methyl)benzonitrile
BD4544741

4-((1H-1,2,4-Triazol-1-yl)methyl)benzonitrile , 90% , 112809-25-3

CAS NO.:112809-25-3

Empirical Formula: C10H8N4

Molecular Weight: 184.2

MDL number: MFCD07368016

Pack Size Price Stock Quantity
250mg RMB138.40 In Stock
1g RMB217.60 In Stock
5g RMB846.40 In Stock
10g RMB1619.20 In Stock
25g RMB2371.20 In Stock
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Update time: 2022-07-08

PRODUCT Properties

Melting point: 69 °C
Boiling point: 412.1±55.0 °C(Predicted)
Density  1.19±0.1 g/cm3(Predicted)
storage temp.  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)

Description and Uses

4-(1H-1,2,4-Triazol-1-ylmethyl)benzonitrile is an intermediate in the synthesis of Letrozole (L330100), an antineoplastic.

Safety

Symbol(GHS) 
GHS07
Signal word  Warning
Hazard statements  H302-H312-H332
Precautionary statements  P280
Hazard Codes  Xn
Risk Statements  10-20/21/22
Safety Statements  16-22-36/37/39
HS Code  2933998090

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