CAS 94171-08-1

2-tert-butyl-6-(chloromethyl)pyrimidin-4(1H)-one

Description:

2-tert-butyl-6-(chloromethyl)pyrimidin-4(1H)-one is a chemical compound characterized by its pyrimidine ring structure, which is a six-membered heterocyclic aromatic ring containing two nitrogen atoms at positions 1 and 3. This compound features a tert-butyl group at the 2-position, contributing to its hydrophobic characteristics and steric bulk. The presence of a chloromethyl group at the 6-position introduces a reactive site, making it useful in various synthetic applications. The carbonyl group at the 4-position indicates that it is a ketone, which can participate in nucleophilic addition reactions. This compound may exhibit biological activity, potentially serving as a precursor or intermediate in the synthesis of pharmaceuticals or agrochemicals. Its unique structure allows for various functionalization possibilities, making it a valuable compound in organic synthesis. Safety and handling precautions should be observed due to the presence of chlorine, which can pose health risks.

Formula: C₉H₁₃ClN₂O

InChI: InChI=1/C9H13ClN2O/c1-9(2,3)8-11-6(5-10)4-7(13)12-8/h4H,5H2,1-3H3,(H,11,12,13)

SMILES: CC(C)(C)c1nc(cc(n1)O)CCl

2-(tert-Butyl)-6-(chloromethyl)pyrimidin-4-ol

CAS: 94171-08-1

2-(tert-Butyl)-6-(chloromethyl)pyrimidin-4-ol

Formula: C₉H₁₃ClN₂O

Purity: ≥95%

Color and Shape: white to off white crystalline solid

Molecular weight: 200.67g/mol

Ref: 54-OR27202

2-tert-Butyl-6-chloromethyl-pyrimidin-4-ol

CAS: 94171-08-1

Formula: C₉H₁₃ClN₂O

Purity: 95.0%

Color and Shape: Solid

Molecular weight: 200.67

Ref: 10-F316664