400858-54-0 | 1-Ethyl-1H-pyrazole-4-carboxylic acid

Packsize	Purity	Availability	Price	Discounted Price
100mg	95%	in stock	$19.00	$13.00
250mg	95%	in stock	$28.00	$19.00
1g	95%	in stock	$50.00	$35.00
2.5g	95%	in stock	$116.00	$82.00
25g	95%	in stock	$1,131.00	$792.00
100g	95%	in stock	$2,810.00	$1,967.00

Description

• Catalog Number: AB58326
• Chemical Name: 1-Ethyl-1H-pyrazole-4-carboxylic acid
• CAS Number: 400858-54-0
• Molecular Formula: C6H8N2O2
• Molecular Weight: 140.13992
• MDL Number: MFCD02090883
• SMILES: CCn1cc(cn1)C(=O)O

Computed Properties

• Complexity: 138
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 10
• Hydrogen Bond Acceptor Count: 3
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 2
• XLogP3: 0.1

Literature

• Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

  Bioorganic & medicinal chemistry letters 20101101