113808-86-9 | 3,5-Dimethyl-1H-pyrazole-4-carboxylic acid

Packsize	Purity	Availability	Price	Discounted Price
250mg	98%	in stock	$15.00	$11.00
1g	98%	in stock	$16.00	$12.00
5g	98%	in stock	$42.00	$30.00
10g	98%	in stock	$82.00	$58.00
25g	98%	in stock	$153.00	$108.00

Description

• Catalog Number: AA12424
• Chemical Name: 3,5-Dimethyl-1H-pyrazole-4-carboxylic acid
• CAS Number: 113808-86-9
• Molecular Formula: C6H8N2O2
• Molecular Weight: 140.13992
• MDL Number: MFCD00159642
• SMILES: OC(=O)c1c(C)n[nH]c1C

Computed Properties

• Complexity: 149
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 10
• Hydrogen Bond Acceptor Count: 3
• Hydrogen Bond Donor Count: 2
• Rotatable Bond Count: 1
• XLogP3: 0.5

Literature

• A soft copper(II) porous coordination polymer with unprecedented aqua bridge and selective adsorption properties.

  Chemistry (Weinheim an der Bergstrasse, Germany) 20121008