700-87-8 | 1-Isocyanato-2-methoxybenzene

Packsize	Purity	Availability	Price	Discounted Price
1g	98%(GC)	in stock	$24.00	$17.00
5g	>98.0%(GC)	in stock	$36.00	$25.00
25g	>98.0%(GC)	in stock	$109.00	$76.00

Description

• Catalog Number: AB62533
• Chemical Name: 1-Isocyanato-2-methoxybenzene
• CAS Number: 700-87-8
• Molecular Formula: C8H7NO2
• Molecular Weight: 149.1467
• MDL Number: MFCD00002004
• SMILES: O=C=Nc1ccccc1OC

Computed Properties

• Complexity: 164
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 11
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• XLogP3: 2.7

Literature

• 2-Methoxyphenyl isocyanate and 2-Methoxyphenyl isothiocyanate: conformers, vibration structure and multiplet Fermi resonance.

  Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20120601

• Iridium-catalyzed [2+2+2] cycloaddition of α,ω-diynes with isocyanates.

  The Journal of organic chemistry 20120120

• Hydroxybenzothiazoles as new nonsteroidal inhibitors of 17β-hydroxysteroid dehydrogenase type 1 (17β-HSD1).

  PloS one 20120101