17564-64-6 | N-(Chloromethyl)phthalimide

Packsize	Purity	Availability	Price	Discounted Price
10g	97%	in stock	$17.00	$12.00

Description

• Catalog Number: AA94537
• Chemical Name: N-(Chloromethyl)phthalimide
• CAS Number: 17564-64-6
• Molecular Formula: C9H6ClNO2
• Molecular Weight: 195.6024
• MDL Number: MFCD00005898
• SMILES: ClCN1C(=O)c2c(C1=O)cccc2
• NSC Number: 29558

Computed Properties

• Complexity: 230
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 13
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• XLogP3: 2.2

Literature

• Density functional theory, comparative vibrational spectroscopic studies, NBO, HOMO-LUMO analyses and thermodynamic functions of N-(bromomethyl)phthalimide and N-(chloromethyl)phthalimide.

  Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20120601