Welcome to LookChem.com Sign In|Join Free

CAS

  • or
4-Amino-3-nitrobenzotrifluoride is an organic compound with the chemical formula C7H4F3N3O2. It is a derivative of benzotrifluoride, featuring an amino group (-NH2) at the 4-position and a nitro group (-NO2) at the 3-position. This yellow crystalline solid is known for its potential applications in the synthesis of pharmaceuticals and agrochemicals, particularly as an intermediate in the production of various active ingredients. The compound's properties, such as its reactivity and stability, make it a valuable building block in the chemical industry. It is important to handle 4-Amino-3-nitrobenzotrifluoride with care due to its potential reactivity and the need to adhere to safety protocols when working with it.

400-98-6 Suppliers

Post Buying Request

Recommended suppliersmore

  • Product
  • FOB Price
  • Min.Order
  • Supply Ability
  • Supplier
  • Contact Supplier
  • 400-98-6 Structure
  • Basic information

    1. Product Name: 4-Amino-3-nitrobenzotrifluoride
    2. Synonyms: 2-Nitro-4-trifluoromethyl-phenylamine;alpha,alpha,alpha-Trifluoro-2-nitro-p-toluidine;Benzenamine, 2-nitro-4-(trifluoromethyl)-;p-Toluidine, alpha,alpha,alpha-trifluoro-2-nitro-;TIMTEC-BB SBB003488;2-NITRO-A,A,A-TRIFLUORO-P-TOLUIDINE;2-NITRO-ALPHA,ALPHA,ALPHA-TRIFLUORO-P-TOLUIDINE;2-NITRO-4-(TRIFLUOROMETHYL)ANILINE
    3. CAS NO:400-98-6
    4. Molecular Formula: C7H5F3N2O2
    5. Molecular Weight: 206.12
    6. EINECS: 206-926-3
    7. Product Categories: Trifluoromethylbenzene serise;Anilines, Aromatic Amines and Nitro Compounds;Aniline;Amines
    8. Mol File: 400-98-6.mol
  • Chemical Properties

    1. Melting Point: 105-106 °C(lit.)
    2. Boiling Point: 265.6 °C at 760 mmHg
    3. Flash Point: 114.4 °C
    4. Appearance: Yellow to golden/Crystals or Crystalline Powder
    5. Density: 1.4711 (estimate)
    6. Vapor Pressure: 8.06mmHg at 25°C
    7. Refractive Index: 1.461
    8. Storage Temp.: Keep in dark place,Inert atmosphere,Room temperature
    9. Solubility: soluble in Methanol,Toluene
    10. PKA: -2.54±0.10(Predicted)
    11. BRN: 650808
    12. CAS DataBase Reference: 4-Amino-3-nitrobenzotrifluoride(CAS DataBase Reference)
    13. NIST Chemistry Reference: 4-Amino-3-nitrobenzotrifluoride(400-98-6)
    14. EPA Substance Registry System: 4-Amino-3-nitrobenzotrifluoride(400-98-6)
  • Safety Data

    1. Hazard Codes: Xn,Xi
    2. Statements: 20/21/22-36/37/38
    3. Safety Statements: 26-36/37
    4. RIDADR: UN2811
    5. WGK Germany: 3
    6. RTECS:
    7. TSCA: Yes
    8. HazardClass: 6.1
    9. PackingGroup: III
    10. Hazardous Substances Data: 400-98-6(Hazardous Substances Data)

400-98-6 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 400-98-6 includes 6 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 3 digits, 4,0 and 0 respectively; the second part has 2 digits, 9 and 8 respectively.
Calculate Digit Verification of CAS Registry Number 400-98:
(5*4)+(4*0)+(3*0)+(2*9)+(1*8)=46
46 % 10 = 6
So 400-98-6 is a valid CAS Registry Number.
InChI:InChI=1/C4H4F3I/c5-3(1-2-8)4(6)7/h1-2H2

400-98-6 Well-known Company Product Price

  • Brand
  • (Code)Product description
  • CAS number
  • Packaging
  • Price
  • Detail
  • Alfa Aesar

  • (A14413)  2-Nitro-4-(trifluoromethyl)aniline, 98%   

  • 400-98-6

  • 10g

  • 413.0CNY

  • Detail
  • Alfa Aesar

  • (A14413)  2-Nitro-4-(trifluoromethyl)aniline, 98%   

  • 400-98-6

  • 50g

  • 1239.0CNY

  • Detail
  • Alfa Aesar

  • (A14413)  2-Nitro-4-(trifluoromethyl)aniline, 98%   

  • 400-98-6

  • 250g

  • 5267.0CNY

  • Detail

400-98-6SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 17, 2017

Revision Date: Aug 17, 2017

1.Identification

1.1 GHS Product identifier

Product name 4-Amino-3-nitrobenzotrifluoride

1.2 Other means of identification

Product number -
Other names 3-NITRO-A,A,A-TRIFLUORO-P-TOLUIDINE

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:400-98-6 SDS

400-98-6Relevant articles and documents

SULFONYL-SUBSTITUTED BICYCLIC COMPOUND WHICH ACTS AS ROR INHIBITOR

-

Paragraph 0415; 0418, (2020/08/16)

Provided is a sulfonyl-substituted bicyclic compound (A) which acts as a RORγ inhibitor, said compound has good RORγ inhibitory activity and is expected to be used for treating diseases mediated by a RORγ receptor in mammals.

Preparation method of 3-hydroxyphenyl trifluoromethyl ether

-

Paragraph 0081; 0084; 0085; 0095; 0099; 0100; 0111; 0112, (2017/09/05)

The invention provides a preparation method of 3-hydroxyphenyl trifluoromethyl ether. The preparation method comprises the following steps: taking 4-trifluoromethoxyaniline as a raw material; and successively carrying out acetylation, nitrification, deacetylation, deaminizating, reduction and hydrolysis reaction on the 4-trifluoromethoxyaniline to obtain the 3-hydroxyphenyl trifluoromethyl ether. The preparation method is high in yield of products, simple to operate and low in production cost; and industrialization is facilitated.

Perenosins: A new class of anion transporter with anti-cancer activity

Van Rossom, Wim,Asby, Daniel J.,Tavassoli, Ali,Gale, Philip A.

supporting information, p. 2645 - 2650 (2016/03/05)

A new class of anion transporter named 'perenosins' consisting of a pyrrole linked through an imine to either an indole, benzimidazole or indazole is reported. The indole containing members of the perenosin family function as effective transmembrane Cl-/NO3- antiporters and HCl cotransporters in a manner similar to the prodigiosenes. The compounds reduce the viability of MDA-MB-231 and MCF-7.

The [Cu]-catalyzed SNAR reactions: Direct amination of electron deficient aryl halides with sodium azide and the synthesis of arylthioethers under Cu(II) - Ascorbate redox system

Goriya, Yogesh,Ramana

experimental part, p. 7642 - 7650 (2010/12/19)

A one pot [Cu]-promoted SNAr reaction of electron-deficient halobenzenes with sodium azide and the reduction of the intermediate aryl azides under the same Cu(II)-ascorbate redox conditions leading to anilines has been documented. Control experiments revealed that both ascorbate and proline play important role in the reaction path way. Further, the use of this catalytic Cu(II)-ascorbate redox system has been explored for the synthesis of arylthioethers.

Benzotriazole UV absorbers having enhanced durability

-

, (2008/06/13)

Benzotriazole UV absorbers which are substituted at the 5-position of the benzo ring by an electron withdrawing group exhibit enhanced durability and very low loss rates when incorporated into automotive coatings. This is particularly the case when the 3-position of the phenyl ring is also substituted by phenyl or phenylalkyl such as alpha -cumyl. Compounds where the 5-position of the benzo ring are substituted by perfluoroalkyl such as trifluoromethyl are particularly of interest for both their enhanced durability and for their excellent solubility and excellent color properties in some thermoplastic compositions when the phenyl ring is substituted at the 3-position by hydrogen or tert-alkyl.

A convenient copper-catalyzed direct animation of nitroarenes with 9-alkylhydroxylamines

Seko, Shinzo,Miyake, Kunihito,Kavvamura, Norio

, p. 1437 - 1444 (2007/10/03)

O-Alkylhydroxylamines, particularly O-methylhydroxylamine, aminate nitroarenes in the presence of a strong base and a copper catalyst to give aminonitroarenes in good yields, ortho- or para-Animation with respect to the nitro group takes place, and in some cases the ortho-aminated product is preferentially obtained. With 3-substituted nitrobenzenes where the substituent has a lone pair of electrons, preferential amination occurs at the 2-position to give the sterically most congested 3c-f, 14 and 22g.

Nitroarylamines via the Vicarious Nucleophilic Substitution of Hydrogen: Amination, Alkylamination, and Arylamination of Nitroarenes with Sulfenamides

Makosza, Mieczyslaw,Bialecki, Maciej

, p. 4878 - 4888 (2007/10/03)

A new reaction of sulfenamides with electrophilic arenes under basic conditions is described. The σ adducts formed from nitroarenes and the anions of sulfenamides undergo elimination of thiol to produce the corresponding o- and/or p-nitroanilines. This reaction is analogous to the known alkylation and hydroxylation of nitroarenes via the vicarious nucleophilic substitution of hydrogen (VNS). The reaction gives access to a wide range of substituted nitroanilines, nitronaphthylamines, and aminoheterocycles. By means of the reaction with N-alkyl- and N-arylsulfenamides, it is possible to obtain N-alkylnitroanilines and nitrodiarylamines. By varying the structure of sulfenamide and the reaction conditions, particularly the nature and concentration of the base, it is possible to control the orientation of animation.

Design and synthesis of new mitochondrial cytotoxin N-thiadiazolylanilines that inhibit tumor cell growth

Hori, Hitoshi,Noguchi, Naoto,Yokoyama, Hideakira,Ise, Hirohiko,Jin, Cheng-Zhe,Kasai, Soko,Goto, Takatsugu,Taira, Zenei

, p. 247 - 253 (2007/10/03)

New N-thiadiazolylanilines were designed and synthesized to develop mitochondrial cytotoxins superior to SF 6847. The mitochondrial cytotoxin N-thiadiazolylanilines, TX-108 and TX-109, inhibited EMT6/KU mammary sarcoma cell growth at a low micromolar concentration. Their inhibitory activities were parallel to their mitochondrial cytotoxicity, such as uncoupling oxidative phosphorylation and inhibiting ATP synthesis. This report also supports the notion that the inhibition of tumor cell growth of inhibitor of protein tyrosine kinase AG17, which is identical to SF 6847, may be due to its mitochondrial cytotoxicity.

Pyrrolylquinoxalinediones: A new class of AMPA receptor antagonists

Lubisch,Behl,Hofmann

, p. 2887 - 2892 (2007/10/03)

Pyrrolylquinoxalinediones were synthesized and their affinities for the AMPA receptor were determined. Most compounds showed moderate to good affinities. The acetic acid derivative 8b exhibited a K(i) value of 70 nM and was equipotent to NBQX 1. Structure activity relationships are discussed. Selected compounds were tested for their potency to inhibit AMPA induced lethal convulsions in mice. In this in vivo model the compounds showed improved potency compared with NBQX.

Post a RFQ

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

1

What can I do for you?
Get Best Price

Get Best Price for 400-98-6