696-40-2

Basic information

• Product Name: 3-Iodobenzylamine
• Synonyms: AURORA KA-7711;3-IODOBENZYLAMINE;RARECHEM AL BW 0705;3-Iodobenzylamine,97%;3-IODOBENZYLAE;3-Iodobenzenemethanamine;3-IodobenzylaMine, 97% 1GR;(3-iodophenyl)MethanaMine
• CAS NO: 696-40-2
• Molecular Formula: C₇H₈IN
• Molecular Weight: 233.05
• EINECS: -0
• Product Categories: Amines;C7;Nitrogen Compounds
• Mol File: 696-40-2.mol
• Article Data: 8

Chemical Properties

• Melting Point: 248-249 °C(Solv: N,N-dimethylformamide (68-12-2))
• Boiling Point: 132 °C8 mm Hg(lit.)
• Flash Point: >230 °F
• Appearance: Clear light yellow/Liquid
• Density: 1.748 g/mL at 25 °C(lit.)
• Refractive Index: 1.638-1.64
• Storage Temp.: under inert gas (nitrogen or Argon) at 2–8 °C
• PKA: 8.79±0.10(Predicted)
• Water Solubility: Difficult to mix in water.
• Sensitive: Air & Light Sensitive
• BRN: 2689602
• CAS DataBase Reference: 3-Iodobenzylamine(CAS DataBase Reference)
• NIST Chemistry Reference: 3-Iodobenzylamine(696-40-2)
• EPA Substance Registry System: 3-Iodobenzylamine(696-40-2)

Safety Data

• Hazard Codes: Xn
• Statements: 36/37/38-42/43-63
• Safety Statements: 23-26-36/37/39
• RIDADR: 2735
• WGK Germany: 3
• HazardClass: 8
• PackingGroup: II
• Hazardous Substances Data: 696-40-2(Hazardous Substances Data)

Usage

Chemical Properties

clear light yellow liquid

Uses

It is a pharmaceutical intermediate.

InChI:InChI=1/C7H8IN/c8-7-3-1-2-6(4-7)5-9/h1-4H,5,9H2

Upstream product

• 200706-60-1 N-(3-iodobenzyl)phthalimide 
• 625-95-6 3-Iodotoluene 
• 60076-09-7 1-(chloromethyl)-3-iodobenzene 
• 49617-83-6 m-Iodobenzyl bromide 
• 69113-59-3 3-iodobenzonitrile 

Downstream Products

• 696-41-3 m-iodobenzaldehyde 
• 80663-95-2 (3-iodobenzyl)guanidine 

Relevant articles and documents

(3-(1H-1,2,3-triazole)phenyl)phosphoric acid derivative as well as preparation method and application thereof

The invention relates to the technical field of medicinal chemistry, and discloses a (3-(1H-1,2,3-triazole)phenyl)phosphoric acid derivative derivative as shown in a formula X which is described in the specification. The derivative has good and broad-spec

Quadruple π stack of two perylene bisimide tweezers: A bimolecular complex with kinetic stability

Self-assembly: A tweezer-type perylene bisimide (PBI) dyad self-assembles into a defined bimolecular complex composed of a quadruple PBI π stack with remarkable kinetic stability, which is unprecedented for π-stacked dye aggregates (see picture). These persistent supramolecular species are of considerable interest for the elucidation of functional properties of dye aggregates. Copyright

Chemistry and folding of photomodulable peptides - Stilbene and thioaurone-type candidates for conformational switches

Optimized synthetic strategies for the preparation of photoswitchable molecular scaffolds based on stilbene or on thioaurone chromophores and their conformationally directing properties, as studied by computations and by NMR spectroscopy, are addressed. For the stilbene peptidomimetics 1, 2 and 3, the length of connecting linkers between the chromophore and the peptide strands was varied, resulting in photochromic dipeptidomimetics with various flexibility. Building blocks of higher rigidity, based on para-substituted thioaurone (4 and 6) and meta-substituted thioaurone chromophores (5 and 7) are shown to have a stronger conformationally directing effect. Design, synthesis, theoretical and experimental conformational analyses are presented.