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4-Fluoro-3-(trifluoromethyl)phenacyl bromid is a chemical compound that belongs to the group of phenacyl bromides. It is characterized by the presence of a trifluoromethyl group attached to the phenyl ring and a bromine atom attached to the phenacyl carbon. 4-Fluoro-3-(trifluoromethyl)phenacyl bromid is recognized for its strong electrophilic properties, which allow it to participate in nucleophilic substitution reactions with various nucleophiles, making it a versatile chemical in synthetic applications. It also serves as a precursor in the synthesis of pharmaceuticals and agrochemicals, highlighting its value in the field of organic chemistry.

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  • 537050-14-9 Structure
  • Basic information

    1. Product Name: 4-FLUORO-3-(TRIFLUOROMETHYL)PHENACYL BROMID
    2. Synonyms: 4-FLUORO-3-(TRIFLUOROMETHYL)PHENACYL BROMID;4-Fluoro-3-(trifluoromethyl)phenacylbromide95%;2-bromo-1-(4-fluoro-3-(trifluoromethyl)phenyl)ethanone;1-[4-fluoro-3-(trifluoroMethyl)phenyl]ethan-1-one broMide;2-Bromo-4'-fluoro-3'-(trifluoromethyl)acetophenone, 2-Bromo-1-[4-fluoro-3-(trifluoromethyl)phenyl]ethan-1-one;2-bromo-1-(4-fluoro-3-(trifluoromethyl)phenyl)ethan-1-one;Ethanone, 2-bromo-1-[4-fluoro-3-(trifluoromethyl)phenyl]-
    3. CAS NO:537050-14-9
    4. Molecular Formula: C9H5BrF4O
    5. Molecular Weight: 285.0330128
    6. EINECS: 1312995-182-4
    7. Product Categories: N/A
    8. Mol File: 537050-14-9.mol
  • Chemical Properties

    1. Melting Point: 42-44
    2. Boiling Point: 250℃
    3. Flash Point: 105℃
    4. Appearance: /
    5. Density: 1.658
    6. Vapor Pressure: 0.0225mmHg at 25°C
    7. Refractive Index: 1.481
    8. Storage Temp.: Keep Cold
    9. Solubility: soluble in Methanol
    10. Sensitive: Lachrymatory
    11. CAS DataBase Reference: 4-FLUORO-3-(TRIFLUOROMETHYL)PHENACYL BROMID(CAS DataBase Reference)
    12. NIST Chemistry Reference: 4-FLUORO-3-(TRIFLUOROMETHYL)PHENACYL BROMID(537050-14-9)
    13. EPA Substance Registry System: 4-FLUORO-3-(TRIFLUOROMETHYL)PHENACYL BROMID(537050-14-9)
  • Safety Data

    1. Hazard Codes: C,Xn
    2. Statements: 22
    3. Safety Statements: N/A
    4. RIDADR: 3261
    5. WGK Germany:
    6. RTECS:
    7. HazardClass: KEEP COLD, LACHRYMATOR, CORROSIV
    8. PackingGroup: III
    9. Hazardous Substances Data: 537050-14-9(Hazardous Substances Data)

537050-14-9 Usage

Uses

Used in Organic Chemistry:
4-Fluoro-3-(trifluoromethyl)phenacyl bromid is used as a reagent for the synthesis of various organic compounds due to its strong electrophilic nature, which facilitates nucleophilic substitution reactions.
Used in Pharmaceutical Synthesis:
In the pharmaceutical industry, 4-Fluoro-3-(trifluoromethyl)phenacyl bromid is used as a precursor in the synthesis of various pharmaceuticals, contributing to the development of new drugs with potential therapeutic applications.
Used in Agrochemical Synthesis:
Similarly, in the agrochemical sector, 4-Fluoro-3-(trifluoromethyl)phenacyl bromid is utilized as a starting material for the synthesis of agrochemicals, playing a role in the creation of compounds that can be used in agriculture for pest control and crop protection.

Check Digit Verification of cas no

The CAS Registry Mumber 537050-14-9 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 5,3,7,0,5 and 0 respectively; the second part has 2 digits, 1 and 4 respectively.
Calculate Digit Verification of CAS Registry Number 537050-14:
(8*5)+(7*3)+(6*7)+(5*0)+(4*5)+(3*0)+(2*1)+(1*4)=129
129 % 10 = 9
So 537050-14-9 is a valid CAS Registry Number.
InChI:InChI=1/C9H5BrF4O/c10-4-8(15)5-1-2-7(11)6(3-5)9(12,13)14/h1-3H,4H2

537050-14-9SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 12, 2017

Revision Date: Aug 12, 2017

1.Identification

1.1 GHS Product identifier

Product name 2-bromo-1-[4-fluoro-3-(trifluoromethyl)phenyl]ethanone

1.2 Other means of identification

Product number -
Other names 4-Fluoro-3-(trifluoromethyl)phenacylbromid

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:537050-14-9 SDS

537050-14-9Relevant articles and documents

DIHYDROOXADIAZINONES FOR THE TREATMENT OF HYPERPROLIFERATIVE DISEASES

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Page/Page column 88-89, (2020/08/22)

The present invention provides dihydrooxydiazinone compounds of general formula (I) : (I), in which R1, R2, R3, and R4, are as defined herein, methods of preparing said compounds, intermediate compounds useful f

6-PHENYL-4,5-DIHYDROPYRIDAZIN-3(2H)-ONE DERIVATIVES AS PDE3A AND PDE3B INHIBITORS FOR TREATING CANCER

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Page/Page column 152, (2019/02/15)

The present invention provides 6-phenyl-4,5-dihydropyridazin-3(2H)- one derivatives of formula (I) : The present invention provides 6-phenyl-4,5-dihydropyridazin-3(2H)- one derivatives of formula (I) :

DIHYDROOXADIAZINONES

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Page/Page column 227; 239, (2019/02/15)

The present invention provides dihydrooxydiazinone compounds of general formula (I) : in which R1, R2, R3, and R4, are as defined herein, methods of preparing said compounds, intermediate compounds useful for preparing said compounds, pharmaceutical compositions and combinations comprising said compounds and the use of said compounds for manufacturing pharmaceutical compositions for the treatment or prophylaxis of diseases, in particular of hyperproliferative diseases, as a sole agent or in combination with other active ingredients.

PYRAZOLO [1,5-A]PYRAZINE DERIVATIVE AS ANTAGONISTS OF V1B RECEPTORS

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Page/Page column 72, (2009/12/05)

The present invention relates to novel compounds of formula (I) or salts thereof: wherein R is -X-[CH2]n CR4R5 -Y; or a group G; G is one of the groups selected from the list consisting of G1, G2, G3, G4, G5, G6, G7, G8, G9, G10, G11 and G12, and the rest

PYRROLO [1, 2-A] PYRAZINE DERIVATIVES AS VASOPRESSIN VIB RECEPTOR ANTAGONISTS

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Page/Page column 92; 93, (2009/12/05)

The present invention relates to novel compounds of formula (I) or salts thereof; wherein R is -X-[CH2]nCR4R5-Y; or a group G; R1 is H or C1 -C4 alkyl; R2 is aryl, heteroaryl or C3-C7 cycloalkyl, which may be substituted with one or more: halogen, C1-C4 alkyl, C1-C4 alkoxy, C1-C4 haloalkyl, C1-C4 haloalkoxy, - CN; R3 is -CH2-C(=O)-NH-R6; X is -CR7R8-, -O-, -NR9-, -S-; Y is-NR10R11 R4 is H or C1 -C4 alkyl; R5 is H or C1 -C4 alkyl; R6 is C1-C6 alkyl, C3-C6 cycloalkyl; C3-C6 cycloalkyl- (C1 -C2 alkyl); which may be substituted by one or more halogen, C1-C4 alkyl, C1-C4 alkoxy, C1-C4 haloalkyl, C1-C4 haloalkoxy; R7 is H or C1 -C4 alkyl; R8 is H or C1 -C4 alkyl; R9 is H or C1 -C4 alkyl; R10 is H or C1-C4 alkyl, or together with R11 forms a 4-8 saturated or unsaturated heterocycle ring which may comprise a further heteroatom selected from O, S and -NR12; such heterocycle may be substituted by one or more halogen, C1-C4 alkyl, C1-C4 alkoxy, C1-C4 haloalkyl, C1-C4 haloalkoxy; R11 is H or C1 -C4 alkyl; R12 is H, C1-C6 alkyl, C3-C7 cycloalkyl; C3-C6 cycloalkyl- (C1 -C2 alkyl); which may be substituted by one or more halogen, C1-C4 alkyl, C1-C4 alkoxy, C1-C4 haloalkyl, C1-C4 haloalkoxy; G is one of the groups selected from the list consisting of G1, G2, G3, G4, G5, G6, G7, G8, G9, G10, G11 and G12; R 13 is H or C1-C4 alkyl, or together with R14 forms a 4-8 saturated or unsaturated heterocycle ring which may comprise a further heteroatom selected from O, S and -NR24; such heterocycle may be substituted by one or more halogen, C1-C4 alkyl, C1-C4 alkoxy, C1-C4 haloalkyl, C1-C4 haloalkoxy; R14 R16 is H, C1-C6 alkyl, C3-C7 cycloalkyl; C3-C6 cycloalkyl- (C1 -C2 alkyl); which may be substituted by one or more halogen, C1-C4 alkyl, C1-C4 alkoxy, C1-C4 haloalkyl, C1-C4 haloalkoxy; R15, R 17 correspond to H or C1-C4 alkyl and may assume different meanings; R 18 is H or C1-C4 alkyl, or together with R17 forms a 4-8 saturated or unsaturated heterocycle ring which may comprise a further heteroatom selected from O, S and -NR25; such heterocycle may be substituted by one or more halogen, C1-C4 alkyl, C1-C4 alkoxy, C1-C4 haloalkyl, C1-C4 haloalkoxy; R19, R20, R21, R22, R23, R24, R25 is H, C1-C6 alkyl, C3-C7 cycloalkyl; C3-C6 cycloalkyl- (C1 -C2 alkyl); which may be substituted by one or more halogen, C1-C4 alkyl, C1-C4 alkoxy, C1-C4 haloalkyl, C1-C4 haloalkoxy; R26, R27, R28, R29 is H, C1-C6 alkyl, C3-C7 cycloalkyl; C3-C6 cycloalkyl- (C1 -C2 alkyl); which may be substituted by one or more halogen, C1-C4 alkyl, C1-C4 alkoxy, C1-C4 haloalkyl, C1-C4 haloalkoxy; I, I' correspond to 1 or 2 and may assume different meanings; m, m', m", m"', mιv, mv correspond to 0, 1 or 2 and may assume different meanings; n is 1, 2 or 3; q is 1, 2 or 3; p, p', p", p'" correspond to 0, 1, 2 or 3 and may assume different meanings; processes for their preparation, intermediates used in these processes, pharmaceutical compositions containing them and their use in therapy, as antagonists of V1b receptors, e.g. to treat depression and anxiety.

UREA DERIVATIVES METHODS FOR THEIR MANUFACTURE AND USES THEREOF

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Page/Page column 46, (2010/11/24)

The present invention provides compounds of formula (I): in which R 1, R'1, R2, R'2, R3, Y and G have the meanings given in the description, to a process for their preparation, their application by way of medicaments, and to pharmaceutical compositions containing them.

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