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745822-33-7

6-Fluorochromano-4-one is a chemical compound with the molecular formula C9H7FO2. It is a fluorinated derivative of chroman-4-one, which is a heterocyclic organic compound consisting of a benzene ring fused to a pyran ring. 6-FLUOROCHROMANO-4-ONE is characterized by the presence of a fluorine atom at the 6-position, which can significantly alter its chemical properties compared to the non-fluorinated parent compound. 6-Fluorochromano-4-one is of interest in organic chemistry and medicinal chemistry due to its potential applications in the synthesis of various pharmaceuticals and agrochemicals. Its unique structure and reactivity make it a valuable building block for the development of new compounds with specific biological activities.

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  • 745822-33-7 Structure

  • Basic information

    1. Product Name: 6-FLUOROCHROMANO-4-ONE
    2. Synonyms: (S)-3-(4-FLUORO-BENZYL)-PIPERIDINE HYDROCHLORIDE;(S)-3-(4-Fluorobenzyl)-piperidine HCl;(S)-3-(4-Fluorobenzyl)Piperidine Hydrochloride(WX604762)
    3. CAS NO:745822-33-7
    4. Molecular Formula: C12H17ClFN
    5. Molecular Weight: 229.72
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 745822-33-7.mol

  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 311.8°C at 760 mmHg
    3. Flash Point: 142.4°C
    4. Appearance: /
    5. Density: N/A
    6. Vapor Pressure: 0.000406mmHg at 25°C
    7. Refractive Index: N/A
    8. Storage Temp.: N/A
    9. Solubility: N/A
    10. CAS DataBase Reference: 6-FLUOROCHROMANO-4-ONE(CAS DataBase Reference)
    11. NIST Chemistry Reference: 6-FLUOROCHROMANO-4-ONE(745822-33-7)
    12. EPA Substance Registry System: 6-FLUOROCHROMANO-4-ONE(745822-33-7)

  • 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: 745822-33-7(Hazardous Substances Data)

745822-33-7 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 745822-33-7 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 7,4,5,8,2 and 2 respectively; the second part has 2 digits, 3 and 3 respectively.
Calculate Digit Verification of CAS Registry Number 745822-33:
(8*7)+(7*4)+(6*5)+(5*8)+(4*2)+(3*2)+(2*3)+(1*3)=177
177 % 10 = 7
So 745822-33-7 is a valid CAS Registry Number.
InChI:InChI=1/C12H16FN.ClH/c13-12-5-3-10(4-6-12)8-11-2-1-7-14-9-11;/h3-6,11,14H,1-2,7-9H2;1H/t11-;/m0./s1

745822-33-7SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 16, 2017

Revision Date: Aug 16, 2017

1.Identification

1.1 GHS Product identifier

Product name 6-FLUOROCHROMANO-4-ONE

1.2 Other means of identification

Product number -
Other names (S)-3-(4-Fluorobenzyl)-piperidine HCl

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:745822-33-7 SDS

745822-33-7Downstream Products

745822-33-7Relevant articles and documents

Discovery of N-propylurea 3-benzylpiperidines as selective CC chemokine receptor-3 (CCR3) antagonists

Varnes, Jeffrey G.,Gardner, Daniel S.,Santella III, Joseph B.,Duncia, John V.,Estrella, Melissa,Watson, Paul S.,Clark, Cheryl M.,Ko, Soo S.,Welch, Patricia,Covington, Maryanne,Stowell, Nicole,Wadman, Eric,Davies, Paul,Solomon, Kimberley,Newton, Robert C.,Trainor, George L.,Decicco, Carl P.,Wacker, Dean A.

, p. 1645 - 1649 (2004)

The discovery of novel and selective small molecule antagonists of the CC Chemokine Receptor-3 (CCR3) is presented. Simple conversion from a 4- to 3-benzylpiperidine gave improved selectivity for CCR3 over the serotonin 5HT2A receptor. Chiral resolution and exploration of mono- and disubstitution of the N-propylurea resulted in several 3-benzylpiperidine N-propylureas with CCR3 binding IC50s under 5 nM. Data from in vitro calcium mobilization and chemotaxis assays for these compounds ranged from high picomolar to low nanomolar EC50s and correlated well with antagonist binding IC50s.

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