1072-91-9 | 1,3,5-Trimethyl-1H-pyrazole

Packsize	Purity	Availability	Price	Discounted Price
25mg	98%	in stock	$15.00	$10.00
5g	98%	in stock	$25.00	$17.00
25g	98%	in stock	$32.00	$22.00
100g	98%	in stock	$97.00	$68.00
500g	98%	in stock	$417.00	$292.00

Description

• Catalog Number: AB57216
• Chemical Name: 1,3,5-Trimethyl-1H-pyrazole
• CAS Number: 1072-91-9
• Molecular Formula: C6H10N2
• Molecular Weight: 110.157
• MDL Number: MFCD00015536
• SMILES: Cc1cc(n(n1)C)C

Computed Properties

• Complexity: 82.6
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 8
• Hydrogen Bond Acceptor Count: 1
• XLogP3: 1

Upstream Synthesis Route

1,3,5-Trimethylpyrazole is a versatile compound widely used in chemical synthesis due to its unique chemical properties. In organic synthesis, it serves as a valuable starting material for the preparation of various important chemical intermediates. One of the key applications of 1,3,5-Trimethylpyrazole is as a building block in the synthesis of pharmaceuticals, agrochemicals, and specialty chemicals. Its ability to undergo selective reactions makes it particularly useful in the formation of complex organic molecules. Additionally, 1,3,5-Trimethylpyrazole can act as a ligand in transition metal-catalyzed reactions, enhancing the efficiency and selectivity of these processes. Its compatibility with a wide range of functional groups further expands its utility in synthetic chemistry.

Literature

• A theoretical insight into the reaction mechanism of photochemical transposition from pyrazole to imidazole.

  The journal of physical chemistry. A 20081016

• Dichloro[(3,5-dimethyl-1H-pyrazol-1-yl)methane]zinc(II) and di-mu-chloro-bis{chloro[(3,5-dimethyl-1H-pyrazol-1-yl)methane]cadmium(II)}.

  Acta crystallographica. Section C, Crystal structure communications 20060201