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4-Fluoro-1H-imidazole is an off-white solid that serves as an antiviral agent and inhibitor of polynucleotide biosynthesis. It is a chemical compound with a unique structure that allows it to interfere with the replication and transcription processes of certain viruses, making it a valuable component in the development of antiviral medications.

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  • 30086-17-0 Structure
  • Basic information

    1. Product Name: 4-FLUORO-1H-IMIDAZOLE
    2. Synonyms: 4-FLUORO-1H-IMIDAZOLE;4-Fluoro-1(3)H-imidazole;1H-Imidazole, 5-fluoro-;5-Fluoro-1H-imidazole;4-Fluoroimidazole;Nsc 208718;4-FI;4(5)-Fluoroimidazole
    3. CAS NO:30086-17-0
    4. Molecular Formula: C3H3FN2
    5. Molecular Weight: 86.0677232
    6. EINECS: N/A
    7. Product Categories: Heterocyclic Compounds;Heterocycles;Fluorinated heterocyclic series
    8. Mol File: 30086-17-0.mol
  • Chemical Properties

    1. Melting Point: 101-1040C
    2. Boiling Point: 261 °C at 760 mmHg
    3. Flash Point: 111.7 °C
    4. Appearance: /
    5. Density: 1.32 g/cm3
    6. Vapor Pressure: 0.0192mmHg at 25°C
    7. Refractive Index: 1.487
    8. Storage Temp.: Refrigerator
    9. Solubility: DMSO, Methanol
    10. PKA: 12.42±0.10(Predicted)
    11. CAS DataBase Reference: 4-FLUORO-1H-IMIDAZOLE(CAS DataBase Reference)
    12. NIST Chemistry Reference: 4-FLUORO-1H-IMIDAZOLE(30086-17-0)
    13. EPA Substance Registry System: 4-FLUORO-1H-IMIDAZOLE(30086-17-0)
  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 30086-17-0(Hazardous Substances Data)

30086-17-0 Usage

Uses

Used in Pharmaceutical Industry:
4-Fluoro-1H-imidazole is used as an antiviral agent for its ability to inhibit the biosynthesis of polynucleotides, which are essential for the replication and transcription of viral genetic material. This property makes it a potential candidate for the development of antiviral drugs that can target a wide range of viruses and help in the treatment of viral infections.
Additionally, due to its chemical properties as an off-white solid, 4-Fluoro-1H-imidazole can be formulated into various pharmaceutical dosage forms, such as tablets, capsules, or suspensions, to ensure optimal bioavailability and therapeutic efficacy.

Check Digit Verification of cas no

The CAS Registry Mumber 30086-17-0 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 3,0,0,8 and 6 respectively; the second part has 2 digits, 1 and 7 respectively.
Calculate Digit Verification of CAS Registry Number 30086-17:
(7*3)+(6*0)+(5*0)+(4*8)+(3*6)+(2*1)+(1*7)=80
80 % 10 = 0
So 30086-17-0 is a valid CAS Registry Number.
InChI:InChI=1/C3H3FN2/c4-3-1-5-2-6-3/h1-2H,(H,5,6)

30086-17-0SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 11, 2017

Revision Date: Aug 11, 2017

1.Identification

1.1 GHS Product identifier

Product name 4-Fluoro-1H-imidazole

1.2 Other means of identification

Product number -
Other names 5-Fluoro-1H-imidazole

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:30086-17-0 SDS

30086-17-0Relevant articles and documents

Determination of inter-ionic and intra-ionic interactions in a monofluorinated imidazolium ionic liquid by a combination of X-ray crystallography and NOE NMR spectroscopy

Lingscheid, Yves,Paul, Mathias,Br?hl, Andreas,Neud?rfl, J?rg-Martin,Giernoth, Ralf

, p. 80 - 85 (2018)

We report the very first application of a Transient 1D 1H{19F} NOE NMR experiment in neat ionic liquids. In comparison with classical 2D HOESY NMR spectroscopy, a substantial reduction in measurement time is gained with comparable quality and information content of the spectra. In combination with classical X-ray crystallography, we have applied this technique for the determination of inter-ionic distances (i.e. probabilities of presence) utilizing an ionic liquid containing a monofluorinated imidazolium cation. Copyright

Synthesis of 4,5-difluoroimidazole

Dolensky, Bohumil,Takeuchi, Yoshio,Cohen, Louis A.,Kirk, Kenneth L.

, p. 147 - 148 (2001)

5-Fluoroimidazole-4-carboxylic acid ethyl ester was converted to the corresponding hydrazide. Oxidation of the hydrazide to the carbonyl azide and Curtius rearrangement in t-butyl alcohol produced 4-t-butyloxycarbonylamino-5-fluoroimidazole. Dissolution o

Novel imidazobenzazepine derivatives as dual H1/5-HT 2A antagonists for the treatment of sleep disorders

Gianotti, Massimo,Corti, Corrado,Fratte, Sonia Delle,Di Fabio, Romano,Leslie, Colin P.,Pavone, Francesca,Piccoli, Laura,Stasi, Luigi,Wigglesworth, Mark J.

supporting information; experimental part, p. 5069 - 5073 (2010/10/20)

A novel imidazobenzazepine template (5a) with potent dual H 1/5-HT2A antagonist activity was identified. Application of a zwitterionic approach to this poorly selective and poorly developable starting point successfully delivered a class of high quality leads, 3-[4-(3-R1-2-R-5H-imidazo[1,2-b][2]benzazepin-11-yl)-1-piperazinyl]- 2,2-dimethylpropanoic acids (e.g., 9, 19, 20, and 21), characterized by potent and balanced H1/5-HT2A receptor antagonist activities and good developability profiles.

NOVEL COMPOUNDS

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Page/Page column 47; 48, (2010/06/19)

Disclosed are N-{[(1R,4S,6R)-3-(2-pyridinylcarbonyl)-3-azabicyclo[4.1.0]hept-4-yl]methyl}-2-heteroarylamine derivatives and their use as pharmaceuticals.

IMIDAZOBENZAZEPINE COMPOUNDS FOR THE TREATMENT OF CENTRAL NERVOUS SYSTEM (CNS) DISEASES

-

Page/Page column 44-45, (2010/12/29)

This invention relates to novel novel imidazobenzazepine derivatives of formula (I) or a pharmaceutically acceptable salt thereof, for treating diseases and conditions of the central nervous system (CNS), in particular sleep disorders.

Regio- and stereoselective glycosylation: Synthesis of 5-haloimidazole α-ribonucleosides

Chandra, Tilak,Zou, Xiang,Valente, Edward J.,Brown, Kenneth L.

, p. 5000 - 5003 (2007/10/03)

We describe the synthesis of novel 5-haloimidazole ribonucleosides as precursors of modified cobalamins. A regio- and stereoselective glycosylation of protected ribose with silylated 4(5)-haloimidazoles produces 5-haloimidazole ribonucleosides predominant

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