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4-CHLORO-2-METHYL-6-NITROANILINE is a chemical with a specific purpose. Lookchem provides you with multiple data and supplier information of this chemical.

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  • 62790-50-5 Structure
  • Basic information

    1. Product Name: 4-CHLORO-2-METHYL-6-NITROANILINE
    2. Synonyms: BenzenaMine, 4-chloro-2-Methyl-6-nitro-;4-CHLORO-2-METHYL-6-NITROANILINE;4-CHLORO-2-METHYL-6-NITRO-PHENYLAMINE;4-CHLORO-6-NITRO-O-TOLUIDINE;TIMTEC-BB SBB003699;4-Chloro-2-methyl-6-nitroaniline,97%;4-chloro-2-nitro-6-methylaniline;2-Amino-5-chloro-3-nitrotoluene, 2-Amino-5-chloro-3-methylnitrobenzene
    3. CAS NO:62790-50-5
    4. Molecular Formula: C7H7ClN2O2
    5. Molecular Weight: 186.6
    6. EINECS: N/A
    7. Product Categories: Anilines, Aromatic Amines and Nitro Compounds;pharmacetical;NULL
    8. Mol File: 62790-50-5.mol
  • Chemical Properties

    1. Melting Point: 126-132 °C
    2. Boiling Point: 328.7 °C at 760 mmHg
    3. Flash Point: 152.6 °C
    4. Appearance: Orange/Crystals or Needles
    5. Density: 1.4800 (rough estimate)
    6. Vapor Pressure: 0.000186mmHg at 25°C
    7. Refractive Index: 1.5560 (estimate)
    8. Storage Temp.: under inert gas (nitrogen or Argon) at 2–8 °C
    9. Solubility: N/A
    10. PKA: -1.18±0.25(Predicted)
    11. CAS DataBase Reference: 4-CHLORO-2-METHYL-6-NITROANILINE(CAS DataBase Reference)
    12. NIST Chemistry Reference: 4-CHLORO-2-METHYL-6-NITROANILINE(62790-50-5)
    13. EPA Substance Registry System: 4-CHLORO-2-METHYL-6-NITROANILINE(62790-50-5)
  • Safety Data

    1. Hazard Codes: Xi
    2. Statements: 36/37/38
    3. Safety Statements: 37/39-26
    4. RIDADR: 2811
    5. WGK Germany:
    6. RTECS:
    7. HazardClass: IRRITANT
    8. PackingGroup: N/A
    9. Hazardous Substances Data: 62790-50-5(Hazardous Substances Data)

62790-50-5 Usage

Chemical Properties

orange crystals or needles

Check Digit Verification of cas no

The CAS Registry Mumber 62790-50-5 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 6,2,7,9 and 0 respectively; the second part has 2 digits, 5 and 0 respectively.
Calculate Digit Verification of CAS Registry Number 62790-50:
(7*6)+(6*2)+(5*7)+(4*9)+(3*0)+(2*5)+(1*0)=135
135 % 10 = 5
So 62790-50-5 is a valid CAS Registry Number.
InChI:InChI=1/C7H7ClN2O2/c1-4-2-5(8)3-6(7(4)9)10(11)12/h2-3H,9H2,1H3

62790-50-5 Well-known Company Product Price

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  • Alfa Aesar

  • (B22253)  4-Chloro-2-methyl-6-nitroaniline, 98%   

  • 62790-50-5

  • 1g

  • 345.0CNY

  • Detail
  • Alfa Aesar

  • (B22253)  4-Chloro-2-methyl-6-nitroaniline, 98%   

  • 62790-50-5

  • 5g

  • 1269.0CNY

  • Detail

62790-50-5SDS

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 4-Chloro-2-methyl-6-nitroaniline

1.2 Other means of identification

Product number -
Other names 4-CHLORO-2-METHYL-6-NITROANILINE

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:62790-50-5 SDS

62790-50-5Relevant articles and documents

Identification of DK419, a potent inhibitor of Wnt/β-catenin signaling and colorectal cancer growth

Wang, Jiangbo,Mook, Robert A.,Ren, Xiu-rong,Zhang, Qingfu,Jing, Genevieve,Lu, Min,Spasojevic, Ivan,Lyerly, H. Kim,Hsu, David,Chen, Wei

, p. 5435 - 5442 (2018)

The Wnt signaling pathway is critical for normal tissue development and is an underlying mechanism of disease when dysregulated. Previously, we reported that the drug Niclosamide inhibits Wnt/β-catenin signaling by decreasing the cytosolic levels of Dishevelled and β-catenin, and inhibits the growth of colon cancers both in vitro and in vivo. Since the discovery of Niclosamide's anthelmintic activity, a growing body of literature indicates that Niclosamide is a multifunctional drug. In an effort to identify derivatives of Niclosamide with improved pharmacokinetic properties that maintain the multifunctional drug activity of Niclosamide for clinical evaluation, we designed DK419, a derivative containing a 1H-benzo[d]imidazole-4-carboxamide substructure, using the structure-activity relationships (SAR) of the Niclosamide salicylanilide chemotype. Similar to Niclosamide, we found DK419 inhibited Wnt/β-catenin signaling, altered cellular oxygen consumption rate and induced production of pAMPK. Moreover, we found DK419 inhibited the growth of CRC tumor cells in vitro, had good plasma exposure when dosed orally, and inhibited the growth of patient derived CRC240 tumor explants in mice dosed orally. DK419, a derivative of Niclosamide with multifunctional activity and improved pharmacokinetic properties, is a promising agent to treat colorectal cancer, Wnt-related diseases and other diseases in which Niclosamide has demonstrated functional activity.

NICLOSAMIDE ANALOGUES AND THERAPEUTIC USE THEREOF

-

Paragraph 00157, (2020/02/23)

Described are niclosamide analogue compounds, pharmaceutical compositions thereof, and method of using the compounds and compositions for treating a disease associated with dysregulation of the Wnt/Frizzled signaling pathway, such as cancer, fatty liver, antibiotic resistance, and viral infection. The disclosed compounds and compositions may also he used for modulating mitochondrial function and for treating certain non-cancer diseases and/or diorders, such as diabetes, fibrotic disease, primary sclerosing cholangitis.

CHEMICAL MODULATORS OF IMMUNE CHECKPOINTS AND THERAPEUTIC USE

-

Paragraph 0242, (2017/07/29)

Compounds and pharmaceutical compositions that down-regulate immune checkpoints such as PD-1, PD-L1 and CTLA-4 are provided. Also provided are methods of treating a disease by down-regulating immune checkpoints such as PD-1, PD-L1 and CTLA-4. The methods

Optimization of potent, selective, and orally bioavailable pyrrolodinopyrimidine-containing inhibitors of heat shock protein 90. Identification of development candidate 2-amino-4-{4-chloro-2-[2-(4-fluoro-1h- pyrazol-1-yl)ethoxy]-6-methylphenyl}-n-(2,2-difluoropropyl)-5, 7-dihydro-6h-pyrrolo[3,4-d]pyrimidine-6-carboxamide

Zehnder, Luke,Bennett, Michael,Meng, Jerry,Huang, Buwen,Ninkovic, Sacha,Wang, Fen,Braganza, John,Tatlock, John,Jewell, Tanya,Zhou, Joe Zhongxiang,Burke, Ben,Wang, Jeff,Maegley, Karen,Mehta, Pramod P.,Yin, Min-Jean,Gajiwala, Ketan S.,Hickey, Michael J.,Yamazaki, Shinji,Smith, Evan,Kang, Ping,Sistla, Anand,Dovalsantos, Elena,Gehring, Michael R.,Kania, Robert,Wythes, Martin,Kung, Pei-Pei

supporting information; experimental part, p. 3368 - 3385 (2011/06/27)

Figure Presented. A novel class of heat shock protein 90 (Hsp90) inhibitors was discovered by high-throughput screening and was subsequently optimized using a combination of structure-based design, parallel synthesis, and the application of medicinal chemistry principles. Through this process, the biochemical and cell-based potency of the original HTS lead were substantially improved along with the corresponding metabolic stability properties. These efforts culminated with the identification of a development candidate (compound 42) which displayed desired PK/PD relationships, significant efficacy in a melanoma A2058 xenograft tumor model, and attractive DMPK profiles.

Broad spectrum chemistry as practised by Novartis process research

Mickel, Stuart J.,Fischer, Reto,Marterer, Wolfgang

, p. 640 - 648 (2007/10/03)

Three actual examples from the current product palette within Novartis Process Research will demonstrate the some of the variety and challenges encountered in modern chemical development.

The nitration of 8-methylquinoxalines in mixed acid

Marterer, Wolfgang,Prikoszovich, Walter,Wiss, Jacques,Prashad, Mahavir

, p. 318 - 323 (2013/09/06)

8-Methylquinoxalines are nitrated surprisingly efficiently at C-5 following a simple nitration protocol with mixed acid at 40-50°C. The implications of halogen functionalisation at C-6 and modification of the mixed acid conditions on the relative rates of conversion and process safety are discussed. Competing side reactions for 6-halo-8-methylquinoxalines involve hydrolysis at C-6 and halogenation at C-7 or C-5.

Research in 7-aminoindazole series: Synthesis of new halo-7H-4-methylpyrazolo[1,5,4-ef][1,5]benzodiazepin-6-ones and 5H-9-halo-6-methylpyrazolo[1,5,4-ef][1,5]benzodiazepin-4-ones

Rakib,Benchidmi,Essassi,El Bouadili,Ibn Mansour,Bellan,Lopez,Lamande

, p. 339 - 345 (2007/10/03)

A new class of 7-aminohaloindazoles has been synthesized. Reactivity of the amino groups of these bicyclic systems has been investigated. The halogenated pyrazolo-1,5-benzodiazepinones have been synthesized by the condensation of 7-aminoindazoles with ethyl acetoacetate.

Practical and efficient chlorination of deactivated anilines and anilides with NCS in 2-propanol

Zanka, Atsuhiko,Kubota, Ariyoshi

, p. 1984 - 1986 (2007/10/03)

Deactivated anilines and anilides were efficiently monochlorinated with NCS in 2-propanol. The described method was applicable to a large scale synthesis.

Oxidative Cyclizations. VII. Cyclization of 2-Substituted Anilines with Alkaline Hypohalite

Dyall, Leonard K.

, p. 2013 - 2026 (2007/10/02)

The Green-Rowe oxidation of 2-nitroanilines with alkaline hypohlorite, to yield benzofuroxans, is demonstrated by studies of the visible spectra of transient intermediates to proceed through N-chlorination and a singlet nitrene.Two variations on the route to the nitrene are possible.The cyclization step is represented as an internal capture of the nitrene by the ortho substituent, and on this basis the Green-Rowe oxidative cyclization is now extended to anilines whose ortho substituent is benzoyl or phenylazo.It is not however successful for ortho phenyl.Azo compounds were observed as byproducts in some of these reactions, and are shown to arise via N,N-dichloroanilines.

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