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1-Bromo-4-fluoro-2-methyl-5-nitrobenzene and 5-Bromo-2-fluoro-4-methylnitrobenzene are organic compounds that are integral to the chemical industry. They are characterized by the presence of bromine, fluorine, methyl, and nitro groups attached to a benzene ring, with the key difference being the arrangement of these substituents on the ring. These compounds are predominantly used as intermediates in the synthesis of more complex organic substances, leveraging the reactivity of their functional groups. Due to their chemical properties, they may pose health risks and should be handled with caution. The environmental impact of these compounds is not well understood, but it is advisable to manage them carefully to minimize exposure.

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  • 170098-98-3 Structure
  • Basic information

    1. Product Name: 1-Bromo-4-fluoro-2-methyl-5-nitrobenzene, 5-Bromo-2-fluoro-4-methylnitrobenzene
    2. Synonyms: 1-Bromo-4-fluoro-2-methyl-5-nitrobenzene, 5-Bromo-2-fluoro-4-methylnitrobenzene;2-Bromo-5-fluoro-4-nitrotoluene 97%;5-BroMo-2-fluoro-4-Methylnitrobenzene;2-BroMo-5-fluoro-4-nitrotoluene;1-Bromo-4-fluoro-2-methyl-5-nitrobenzene;2-Bromo-5-fluoro-4-nitrotoluene97%;Benzene, 1-bromo-4-fluoro-2-methyl-5-nitro-
    3. CAS NO:170098-98-3
    4. Molecular Formula: C7H5BrFNO2
    5. Molecular Weight: 234.0225032
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 170098-98-3.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 290.7±35.0 °C(Predicted)
    3. Flash Point: N/A
    4. Appearance: /
    5. Density: 1.696±0.06 g/cm3(Predicted)
    6. Refractive Index: N/A
    7. Storage Temp.: Sealed in dry,Room Temperature
    8. Solubility: Chloroform (Slightly), DMSO (Slightly)
    9. CAS DataBase Reference: 1-Bromo-4-fluoro-2-methyl-5-nitrobenzene, 5-Bromo-2-fluoro-4-methylnitrobenzene(CAS DataBase Reference)
    10. NIST Chemistry Reference: 1-Bromo-4-fluoro-2-methyl-5-nitrobenzene, 5-Bromo-2-fluoro-4-methylnitrobenzene(170098-98-3)
    11. EPA Substance Registry System: 1-Bromo-4-fluoro-2-methyl-5-nitrobenzene, 5-Bromo-2-fluoro-4-methylnitrobenzene(170098-98-3)
  • 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: 170098-98-3(Hazardous Substances Data)

170098-98-3 Usage

Uses

Used in Chemical Synthesis:
1-Bromo-4-fluoro-2-methyl-5-nitrobenzene, 5-Bromo-2-fluoro-4-methylnitrobenzene is used as a synthetic intermediate for the production of more complex organic compounds. The functional groups present in these molecules make them versatile building blocks in the synthesis of a wide range of chemical products.
Used in Pharmaceutical Industry:
1-Bromo-4-fluoro-2-methyl-5-nitrobenzene, 5-Bromo-2-fluoro-4-methylnitrobenzene is used as a precursor in the development of pharmaceuticals. Their unique structures can be further modified to create new drug candidates with potential therapeutic applications.
Used in Dye and Pigment Production:
1-Bromo-4-fluoro-2-methyl-5-nitrobenzene, 5-Bromo-2-fluoro-4-methylnitrobenzene is used as a starting material in the production of dyes and pigments. The presence of bromine and nitro groups can contribute to the color properties of the final products.
Used in Agrochemicals:
1-Bromo-4-fluoro-2-methyl-5-nitrobenzene, 5-Bromo-2-fluoro-4-methylnitrobenzene is used as a component in the formulation of agrochemicals. Their chemical properties may be harnessed to develop new pesticides or herbicides with improved efficacy and selectivity.

Check Digit Verification of cas no

The CAS Registry Mumber 170098-98-3 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,7,0,0,9 and 8 respectively; the second part has 2 digits, 9 and 8 respectively.
Calculate Digit Verification of CAS Registry Number 170098-98:
(8*1)+(7*7)+(6*0)+(5*0)+(4*9)+(3*8)+(2*9)+(1*8)=143
143 % 10 = 3
So 170098-98-3 is a valid CAS Registry Number.

170098-98-3SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 19, 2017

Revision Date: Aug 19, 2017

1.Identification

1.1 GHS Product identifier

Product name 1-Bromo-4-fluoro-2-methyl-5-nitrobenzene

1.2 Other means of identification

Product number -
Other names 5-Bromo-2-fluoro-4-methylnitrobenzene

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:170098-98-3 SDS

170098-98-3Upstream product

170098-98-3Relevant articles and documents

Preparation of a first 18F-labeled agonist for M1 muscarinic acetylcholine receptors

Drewes, Birte,Kolks, Niklas,Neumaier, Bernd,Neumaier, Felix,Rüngeler, Till,Zlatopolskiy, Boris D.

, (2020/07/10)

M1 muscarinic acetylcholine receptors (mAChRs) are abundant in postsynaptic nerve terminals of all forebrain regions and have been implicated in the cognitive decline associated with Alzheimer’s disease and other CNS pathologies. Consequently,

AURORA AND FLT3 KINASES MODULATORS

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Paragraph 0193, (2015/02/18)

The invention provides a compound having the formula (1): and salts thereof; wherein: R1 is hydrogen or C1-2 alkyl; and R2, R3 and R4 are the same or different and each is selected from hydrogen, C1-2 alkyl, fluorine, chlorine, C1-2 alkoxy and trifluoromethyl, provided that no more than two of R2, R3 and R4 are other than hydrogen. Also provided are pharmaceutical compositions containing the compounds and their use in medicine, and in particular in the treatment of cancer.

Discovery of 1-(3,3-dimethylbutyl)-3-(2-fluoro-4-methyl-5-(7-methyl-2-(methylamino)pyrido[2,3- d ]pyrimidin-6-yl)phenyl)urea (LY3009120) as a pan-RAF inhibitor with minimal paradoxical activation and activity against BRAF or RAS mutant tumor cells

Henry, James R.,Kaufman, Michael D.,Peng, Sheng-Bin,Ahn, Yu Mi,Caldwell, Timothy M.,Vogeti, Lakshminarayana,Telikepalli, Hanumaiah,Lu, Wei-Ping,Hood, Molly M.,Rutkoski, Thomas J.,Smith, Bryan D.,Vogeti, Subha,Miller, David,Wise, Scott C.,Chun, Lawrence,Zhang, Xiaoyi,Zhang, Youyan,Kays, Lisa,Hipskind, Philip A.,Wrobleski, Aaron D.,Lobb, Karen L.,Clay, Julia M.,Cohen, Jeffrey D.,Walgren, Jennie L.,McCann, Denis,Patel, Phenil,Clawson, David K.,Guo, Sherry,Manglicmot, Danalyn,Groshong, Chris,Logan, Cheyenne,Starling, James J.,Flynn, Daniel L.

supporting information, p. 4165 - 4179 (2015/06/08)

The RAS-RAF-MEK-MAPK cascade is an essential signaling pathway, with activation typically mediated through cell surface receptors. The kinase inhibitors vemurafenib and dabrafenib, which target oncogenic BRAF V600E, have shown significant clinical efficac

Compositions for Treatment of Cystic Fibrosis and Other Chronic Diseases

-

Paragraph 1250, (2015/09/22)

The present invention relates to pharmaceutical compositions comprising an inhibitor of epithelial sodium channel activity in combination with at least one ABC Transporter modulator compound of Formula A, Formula B, Formula C, or Formula D. The invention also relates to pharmaceutical formulations thereof, and to methods of using such compositions in the treatment of CFTR mediated diseases, particularly cystic fibrosis using the pharmaceutical combination compositions.

Substituted phenylimidazopyrazoles and their use

-

Paragraph 0698; 0699; 0700, (2013/07/31)

The present application relates to novel 1-phenyl-1H-imidazo[1,2-b]pyrazole derivatives, to processes for their preparation, to their use for the treatment and/or prevention of diseases and to their use for preparing medicaments for the treatment and/or prevention of diseases, in particular angiogenic disorders and hyperproliferative disorders, where neovascularization plays a role, such as, for example, neoplastic disorders and tumour disorders. Such treatments can be carried out as monotherapy or else in combination with other medicaments or further therapeutic measures.

AURORA AND FLT3 KINASES MODULATORS

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Page/Page column 43, (2013/08/28)

The invention provides a compound having the formula (1) useful as modulator of the activity of Aurora kinases and FLT3 kinases: and salts thereof; wherein: R1 is hydrogen or C1-2 alkyl; and R2, R3 and R4 are the same or different and each is selected from hydrogen, C1-2 alkyl, fluorine, chlorine, C1-2 alkoxy and trifluoromethyl, provided that no more than two of R2, R3 and R4 are other than hydrogen. Also provided are pharmaceutical compositions containing the compounds and their use in medicine, and in particular in the treatment of cancer

2-AMINO, 6-PHENYL SUBSTITUTED PYRIDO [2, 3 - D] PYRIMIDINE DERIVATIVES USEFUL AS RAF KINASE INHIBITORS

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Page/Page column 10, (2013/09/26)

The present invention provides the compound l-(3,3-Dimethylbutyl) -3-(2-fluoro-4-methyl-5-(7-methyl-2-(methylamino)pyrido[2,3-d]pyrimidin-6-yl)phenyl)urea or a pharmaceutically acceptable salt thereof, that inhibits Raf and, therefore, may be useful in tr

RAF INHIBITOR COMPOUNDS

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Page/Page column 42, (2013/09/26)

This invention provides compounds of Formula (I) or a pharmaceutically acceptable salt thereof; pharmaceutical compositions comprising a compound of Formula (I); and use of a compound of Formula (I) for treating specified cancers.

COMPOSITIONS FOR TREATMENT OF CYSTIC FIBROSIS AND OTHER CHRONIC DISEASES

-

, (2012/04/23)

The present invention relates to pharmaceutical compositions comprising an inhibitor of epithelial sodium channel activity in combination with at least one ABC Transporter modulator compound of Formula A, Formula B, Formula C, or Formula D. The invention also relates to pharmaceutical formulations thereof, and to methods of using such compositions in the treatment of CFTR mediated diseases, particularly cystic fibrosis using the pharmaceutical combination compositions.

Modulators of ATP-binding cassette transporters

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Page/Page column 407, (2008/06/13)

Compounds of the present invention and pharmaceutically acceptable compositions thereof, are useful as modulators of ATP-Binding Cassette (“ABC”) transporters or fragments thereof, including Cystic Fibrosis Transmembrane Conductance Regulator (“CFTR”). The present invention also relates to methods of treating ABC transporter mediated diseases using compounds of the present invention.

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