71022-43-0 | 3,5-Dinitrobenzyl alcohol

Packsize	Purity	Availability	Price	Discounted Price
1g	98%	in stock	$19.00	$13.00
5g	98%	in stock	$33.00	$24.00
25g	98%	in stock	$153.00	$107.00
100g	98%	in stock	$556.00	$390.00

Description

• Catalog Number: AC81718
• Chemical Name: 3,5-Dinitrobenzyl alcohol
• CAS Number: 71022-43-0
• Molecular Formula: C7H6N2O5
• Molecular Weight: 198.13294
• MDL Number: MFCD00007235
• SMILES: OCc1cc(cc(c1)N(=O)=O)N(=O)=O

Computed Properties

• Complexity: 211
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 14
• Hydrogen Bond Acceptor Count: 5
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 1
• XLogP3: 0.7

Literature

• 3,5-Dinitro-benzyl methane-sulfonate.

  Acta crystallographica. Section E, Structure reports online 20080801

• Pi-Pi complexation of bupivacaine and analogues with aromatic receptors: implications for overdose remediation.

  International journal of nanomedicine 20070901