105969-16-2

Basic information

• Product Name: 3,5-DIFLUORO-4-METHOXYBENZYLAMINE
• Synonyms: 3,5-DIFLUORO-4-METHOXYBENZYLAMINE;(3,5-difluoro-4-methoxyphenyl)methanamine;(3,5-Difluoro-4-methoxyphenyl)
• CAS NO: 105969-16-2
• Molecular Formula: C₈H₉F₂NO
• Molecular Weight: 173.16
• Mol File: 105969-16-2.mol
• Article Data: 3

Chemical Properties

• Boiling Point: 231.6 °C at 760 mmHg
• Flash Point: 93.9 °C
• Appearance: /
• Density: 1.22 g/cm³
• Vapor Pressure: 0.0617mmHg at 25°C
• Refractive Index: 1.4980
• Storage Temp.: Keep in dark place,Inert atmosphere,Room temperature
• Sensitive: Air Sensitive
• CAS DataBase Reference: 3,5-DIFLUORO-4-METHOXYBENZYLAMINE(CAS DataBase Reference)
• NIST Chemistry Reference: 3,5-DIFLUORO-4-METHOXYBENZYLAMINE(105969-16-2)
• EPA Substance Registry System: 3,5-DIFLUORO-4-METHOXYBENZYLAMINE(105969-16-2)

Safety Data

• Hazard Codes: T
• Statements: 25
• Safety Statements: 45
• HazardClass: 8
• PackingGroup: III
• Hazardous Substances Data: 105969-16-2(Hazardous Substances Data)

Usage

General Description

3,5-Difluoro-4-methoxybenzylamine is a chemical compound with the molecular formula C8H8F2NO. It is an aromatic secondary amine that incorporates both fluorine and oxygen functional groups. While its applications are not widely documented, it seems to be utilized primarily in the field of organic synthesis, where it could serve as a precursor or intermediary in the creation of more complex molecules. As with any chemical substance, proper handling and care should be applied due to potential hazards associated with its use. Its physical and chemical properties, as well as potential applications, are still the subject of ongoing research.

InChI:InChI=1/C8H9F2NO/c1-12-8-6(9)2-5(4-11)3-7(8)10/h2-3H,4,11H2,1H3

Upstream product

• 104197-15-1 3,5-difluoro-4-methoxybenzonitrile 

Downstream Products

• 1451996-23-8 C₁₇H₁₆F₂N₄O₂S 
• 1624256-36-5 8-(3,5-difluoro-4-methoxybenzyl)-1,3-dimethyl-6,7,8,9-tetrahydropyrazino[2,1-f]purine-2,4(1H,3H)-dione 
• 1434125-82-2 C₁₀₂H₁₂₇F₂N₁₇O₁₈ 
• 107186-82-3 3,5-difluoro-4-methoxybenzyl isothiocyanate 
• 107186-85-6 4-(3,5-difluoro-4-methoxybenzyl)-1-formyl-3-thiosemicarbazide 
• 105968-93-2 1-(3,5-difluoro-4-methoxybenzyl)benzimidazole-2-thione 
• 107186-79-8 4-(3,5-difluoro-4-methoxybenzyl)-1,2,4-triazole-3-thione 
• 105968-97-6 1-(3,5-difluoro-4-hydroxybenzyl)benzimidazole-2-thione 
• 107186-80-1 4-(3,5-difluoro-4-hydroxybenzyl)-1,2,4-triazole-3-thione 
• 105969-11-7 N-(3,5-difluoro-4-methoxybenzyl)-2-nitroaniline 

Relevant articles and documents

Some Benzyl-Substituted Imidazoles, Triazoles, Tetrazoles, Pyridinethiones, and Structural Relatives as Multisubstrate Inhibitors of Dopamine β-Hydroxylase. 4. Structure-Activity Relationships at the Copper Binding Site

Structure-activity relationships (SAR) were determined for novel multisubstrate inhibitors of dopamine β-hydroxylase (DBH; EC 1.14.17.1) by examining the effects upon in vitro inhibitory potencies resulting from structural changes at the copper-binding region of inhibitor.Attempts were made to determine replacement groups for the thione sulfur atom of the prototypical inhibitor 1-(4-hydroxybenzyl)imidazole-2-thione described previously.The synthesis and evaluation of oxygen and nitrogen analogues of the soft thione group demonstrated the sulfur atom to be necessary for optimal activity.An additional series of imidazole-2-thione relatives was prepared in an effort to probe the relationship between the pKa of the ligand group and inhibitor potency.In vitro inhibitory potency was shown not to correlate with ligand pKa over a range of approximately 10 pKa units, and a rationale for this is advanced.Additional ligand modifications were prepared in order to explore bulk tolerance at the enzyme oxygen binding site and to determine the effects of substituting a six-membered ligand group for the five-membered imidazole-2-thione ligand.

1-substituted-2-mercapto benzimidazole compounds and intermediates

1-substituted-2-mercapto(or aminomethyl)benzimidazole compounds of the formula STR1 inhibit dopamine-β-hydroxylase activity. Intermediates are also disclosed.