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3,3,3-Tris(4-chlorophenyl)propionic acid is an organic compound characterized by its unique structure, featuring three 4-chlorophenyl groups attached to a propionic acid backbone. This molecule exhibits specific chemical properties that make it a valuable entity in various applications, particularly in the realm of biochemistry and pharmaceuticals.

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  • 2168-06-1 Structure
  • Basic information

    1. Product Name: 3,3,3-Tris(4-chlorophenyl)propionic acid
    2. Synonyms: RARECHEM AL BO 1263;3,3,3-TRIS(4-CHLOROPHENYL)PROPIONIC ACID;3,3,3-tris(p-chlorophenyl)propionic acid;3,3,3,-Trise-(4-Chlorophenyl)-PropionicAcid;3,3,3-Tris(4-chlorophenyl)propionis acid;3,3,3-Tris-(4-Chlorophenyl)-Pr;3,3,3-tri-(4-Chlorophenyl)propionicacid;3,3,3-TRIS(4-CHLOROPHENYL)PROPIONIC ACID,=98.3% (HPLC)
    3. CAS NO:2168-06-1
    4. Molecular Formula: C21H15Cl3O2
    5. Molecular Weight: 405.7
    6. EINECS: 218-509-3
    7. Product Categories: C13 to C42+;Carbonyl Compounds;Carboxylic Acids
    8. Mol File: 2168-06-1.mol
  • Chemical Properties

    1. Melting Point: 190-193 °C(lit.)
    2. Boiling Point: 505.8 °C at 760 mmHg
    3. Flash Point: 259.7 °C
    4. Appearance: /
    5. Density: 1.369 g/cm3
    6. Vapor Pressure: 4.74E-11mmHg at 25°C
    7. Refractive Index: 1.627
    8. Storage Temp.: Sealed in dry,Room Temperature
    9. Solubility: N/A
    10. CAS DataBase Reference: 3,3,3-Tris(4-chlorophenyl)propionic acid(CAS DataBase Reference)
    11. NIST Chemistry Reference: 3,3,3-Tris(4-chlorophenyl)propionic acid(2168-06-1)
    12. EPA Substance Registry System: 3,3,3-Tris(4-chlorophenyl)propionic acid(2168-06-1)
  • Safety Data

    1. Hazard Codes: Xi
    2. Statements: 36/37/38
    3. Safety Statements: 26-37/39
    4. WGK Germany: 3
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 2168-06-1(Hazardous Substances Data)

2168-06-1 Usage

Uses

Used in Pharmaceutical Industry:
3,3,3-Tris(4-chlorophenyl)propionic acid is used as a potent inhibitor for Yersinia PTP (protein-tyrosine phosphatase) YopH. This application is significant due to its role in targeting and managing the activity of a specific enzyme, which can have implications in treating diseases where this enzyme plays a critical role in the pathology.
Given the provided information, the uses of 3,3,3-Tris(4-chlorophenyl)propionic acid are primarily focused on its inhibitory role in the pharmaceutical industry. Further research and development may reveal additional applications in different fields, but as per the current data, its primary use is as an inhibitor for Yersinia PTP YopH.

Check Digit Verification of cas no

The CAS Registry Mumber 2168-06-1 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 2,1,6 and 8 respectively; the second part has 2 digits, 0 and 6 respectively.
Calculate Digit Verification of CAS Registry Number 2168-06:
(6*2)+(5*1)+(4*6)+(3*8)+(2*0)+(1*6)=71
71 % 10 = 1
So 2168-06-1 is a valid CAS Registry Number.
InChI:InChI=1/C21H15Cl3O2/c22-17-7-1-14(2-8-17)21(13-20(25)26,15-3-9-18(23)10-4-15)16-5-11-19(24)12-6-16/h1-12H,13H2,(H,25,26)

2168-06-1SDS

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 3,3,3-tris(4-chlorophenyl)propanoic acid

1.2 Other means of identification

Product number -
Other names 3,3,3-Tris(4-chlorophenyl) propionic acid

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:2168-06-1 SDS

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