4198-90-7 | 3,5-Dimethyl-4-hydroxybenzonitrile

Packsize	Purity	Availability	Price	Discounted Price
5g	97%	in stock	$12.00	$9.00
25g	97%	in stock	$20.00	$14.00
100g	97%	in stock	$54.00	$38.00
500g	97%	in stock	$231.00	$162.00

Description

• Catalog Number: AB63980
• Chemical Name: 3,5-Dimethyl-4-hydroxybenzonitrile
• CAS Number: 4198-90-7
• Molecular Formula: C9H9NO
• Molecular Weight: 147.17386
• MDL Number: MFCD00221716
• SMILES: N#Cc1cc(C)c(c(c1)C)O

Computed Properties

• Complexity: 169
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 11
• Hydrogen Bond Acceptor Count: 2
• Hydrogen Bond Donor Count: 1
• XLogP3: 1.1

Literature

• Cyanation of arenes via iridium-catalyzed borylation.

  Journal of the American Chemical Society 20100825

• Polarizable continuum model associated with the self-consistent-reaction field for molecular adsorbates at the interface.

  Physical chemistry chemical physics : PCCP 20100107