28178-42-9 | 2,6-Diisopropylphenyl isocyanate

Packsize	Purity	Availability	Price	Discounted Price
1g	95%	in stock	$19.00	$13.00
5g	95%	in stock	$79.00	$55.00
25g	95%	in stock	$262.00	$183.00

Description

• Catalog Number: AB60682
• Chemical Name: 2,6-Diisopropylphenyl isocyanate
• CAS Number: 28178-42-9
• Molecular Formula: C13H17NO
• Molecular Weight: 203.2802
• MDL Number: MFCD00008882
• SMILES: CC(c1cccc(c1N=C=O)C(C)C)C

Computed Properties

• Complexity: 225
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 15
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• XLogP3: 5

Literature

• 4D-QSAR analysis of a set of propofol analogues: mapping binding sites for an anesthetic phenol on the GABA(A) receptor.

  Journal of medicinal chemistry 20020718

• [Disorders of antioxidant defence and their correction in experimental di-isopropyl-phenyl-isocyanate intoxication].

  Meditsina truda i promyshlennaia ekologiia 20020101