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5000-63-5

3-(2,4,5-trichlorophenoxy)propane-1,2-diyl diacetate, also known as 2,4,5-T diacetate, is a chemical compound derived from the herbicide 2,4,5-T. It is formed by the esterification of 2,4,5-T with acetic acid, resulting in a diester product. 3-(2,4,5-trichlorophenoxy)propane-1,2-diyl diacetate has been used as a selective herbicide, particularly for controlling broadleaf weeds in agricultural settings. However, due to concerns over its potential health and environmental impacts, including the formation of dioxins as byproducts, its use has been restricted or banned in many countries. The compound is characterized by its ability to mimic the action of plant hormones, leading to uncontrolled growth and ultimately the death of the targeted weeds. Despite its effectiveness, the legacy of 2,4,5-T and its diacetate derivative remains controversial due to their association with environmental contamination and health risks.

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  • 5000-63-5 Structure

  • Basic information

    1. Product Name: 3-(2,4,5-trichlorophenoxy)propane-1,2-diyl diacetate
    2. Synonyms:
    3. CAS NO:5000-63-5
    4. Molecular Formula: C8H7NO5
    5. Molecular Weight: 355.5983
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 5000-63-5.mol

  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 445.7°C at 760 mmHg
    3. Flash Point: 171.8°C
    4. Appearance: N/A
    5. Density: 1.39g/cm3
    6. Vapor Pressure: 3.86E-08mmHg at 25°C
    7. Refractive Index: 1.529
    8. Storage Temp.: N/A
    9. Solubility: N/A
    10. CAS DataBase Reference: 3-(2,4,5-trichlorophenoxy)propane-1,2-diyl diacetate(CAS DataBase Reference)
    11. NIST Chemistry Reference: 3-(2,4,5-trichlorophenoxy)propane-1,2-diyl diacetate(5000-63-5)
    12. EPA Substance Registry System: 3-(2,4,5-trichlorophenoxy)propane-1,2-diyl diacetate(5000-63-5)

  • 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: 5000-63-5(Hazardous Substances Data)

5000-63-5 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 5000-63-5 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 5,0,0 and 0 respectively; the second part has 2 digits, 6 and 3 respectively.
Calculate Digit Verification of CAS Registry Number 5000-63:
(6*5)+(5*0)+(4*0)+(3*0)+(2*6)+(1*3)=45
45 % 10 = 5
So 5000-63-5 is a valid CAS Registry Number.

5000-63-5Upstream product

5000-63-5Relevant articles and documents

Gabapentin-base synthesis and theoretical studies of biologically active compounds: N-cyclohexyl-3-oxo-2-(3-oxo-2-azaspiro[4.5] decan-2-yl)-3-arylpropanamides and N-(tert-butyl)-2-(3-oxo-2-azaspiro[4.5]decan-2-yl)-2-arylacetamide derivatives

Amirani Poor, Mahboobe,Darehkordi, Ali,Anary-Abbasinejad, Mohammad,Mohammadi, Marziyeh

, p. 44 - 52 (2018)

An intermolecular Ugi reaction of 2-(1-(aminomethyl)cyclohexyl)acetic acid (gabapentin) with glyoxal and cyclohexyl isocyanide or aromatic aldehyde and tertbutyl isocyanide under mild conditions in ethanol have been developed to produce two novel class of N-cyclohexyl-3-(aryl)-3-oxo-2-(3-oxo-2-azaspiro[4.5]decan-2-yl)propanamideins and N-(tert-butyl)-2-(3-oxo-2-azaspiro[4.5]decan-2-yl)-2-arylacetamide derivatives in good to excellent yields. This presents the first report for the intermolecular Ugi three component reaction of gabapentin, glyoxal, and an isocyanide. Also according to the theoretical studies the electron-donating groups increase the strength of intramolecular hydrogen bond and electron-withdrawing groups decrease the strength of intramolecular hydrogen bond.

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