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4-[(1,1-Dioxo-1λ6,4-thiazinan-4-yl)methyl]benzoic acid is a chemical compound characterized by its unique molecular formula C15H13NO4S. It is a thiazine derivative that features a benzene ring and a carboxylic acid functional group, which may confer it with diverse chemical properties and potential applications in various fields.

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  • 465514-21-0 Structure
  • Basic information

    1. Product Name: 4-[(1,1-DIOXO-1LAMBDA6,4-THIAZINAN-4-YL)METHYL]BENZOIC ACID
    2. Synonyms: 4-(1,1-DIOXO-1LAMBDA*6*-THIOMORPHOLIN-4-YLMETHYL)BENZOIC ACID;4-(4'-Carboxybenzyl)thiomorpholine 1,1-dioxide, Tech.;4-[(1,1-Dioxidothiomorpholin-4-yl)methyl]benzoic acid;4-(4'-Carboxybenzyl)thiomorpholine 1,1-dioxide;4-[(1,1-DIOXO-1LAMBDA6,4-THIAZINAN-4-YL)METHYL]BENZENECARBOXYLIC ACID;4-[(1,1-DIOXO-1LAMBDA6,4-THIAZINAN-4-YL)METHYL]BENZOIC ACID;4-[(1,1-dioxo-1lambdamu~,4-thiazinan-4-yl)methyl]benzoic acid
    3. CAS NO:465514-21-0
    4. Molecular Formula: C12H15NO4S
    5. Molecular Weight: 269.32
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 465514-21-0.mol
  • Chemical Properties

    1. Melting Point: 222 °C
    2. Boiling Point: 512.4°C at 760 mmHg
    3. Flash Point: 263.7°C
    4. Appearance: /
    5. Density: 1.381g/cm3
    6. Vapor Pressure: 2.52E-11mmHg at 25°C
    7. Refractive Index: 1.601
    8. Storage Temp.: N/A
    9. Solubility: N/A
    10. CAS DataBase Reference: 4-[(1,1-DIOXO-1LAMBDA6,4-THIAZINAN-4-YL)METHYL]BENZOIC ACID(CAS DataBase Reference)
    11. NIST Chemistry Reference: 4-[(1,1-DIOXO-1LAMBDA6,4-THIAZINAN-4-YL)METHYL]BENZOIC ACID(465514-21-0)
    12. EPA Substance Registry System: 4-[(1,1-DIOXO-1LAMBDA6,4-THIAZINAN-4-YL)METHYL]BENZOIC ACID(465514-21-0)
  • Safety Data

    1. Hazard Codes: Xi
    2. Statements: R36/37/38:Irritating to eyes, respiratory system and skin.;
    3. Safety Statements: S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.; S37/39:Wear suitable g
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: IRRITANT
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 465514-21-0(Hazardous Substances Data)

465514-21-0 Usage

Uses

As the provided materials do not specify the exact applications of 4-[(1,1-Dioxo-1λ6,4-thiazinan-4-yl)methyl]benzoic acid, the following uses are hypothetical and would require further research and testing to confirm:
Used in Pharmaceutical Industry:
4-[(1,1-Dioxo-1λ6,4-thiazinan-4-yl)methyl]benzoic acid could be used as a pharmaceutical intermediate for the synthesis of various therapeutic agents. Its unique chemical structure may allow it to interact with biological targets, potentially leading to the development of new drugs for treating a range of diseases.
Used in Chemical Synthesis:
In the chemical industry, 4-[(1,1-Dioxo-1λ6,4-thiazinan-4-yl)methyl]benzoic acid might serve as a building block or reactant in the synthesis of other complex organic compounds. Its benzene ring and carboxylic acid group could be key functional groups in the formation of new molecules with specific properties.
Used in Material Science:
4-[(1,1-DIOXO-1LAMBDA6,4-THIAZINAN-4-YL)METHYL]BENZOIC ACID's structure may also lend itself to applications in material science, where it could be used to develop new materials with unique properties, such as improved stability, conductivity, or other characteristics.
Used in Research and Development:
4-[(1,1-Dioxo-1λ6,4-thiazinan-4-yl)methyl]benzoic acid could be a valuable compound for research purposes, where it can be studied to understand its reactivity, stability, and potential interactions with other molecules. This knowledge could lead to new discoveries and applications in various scientific fields.

Check Digit Verification of cas no

The CAS Registry Mumber 465514-21-0 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 4,6,5,5,1 and 4 respectively; the second part has 2 digits, 2 and 1 respectively.
Calculate Digit Verification of CAS Registry Number 465514-21:
(8*4)+(7*6)+(6*5)+(5*5)+(4*1)+(3*4)+(2*2)+(1*1)=150
150 % 10 = 0
So 465514-21-0 is a valid CAS Registry Number.
InChI:InChI=1/C12H15NO4S/c14-12(15)11-3-1-10(2-4-11)9-13-5-7-18(16,17)8-6-13/h1-4H,5-9H2,(H,14,15)

465514-21-0Relevant articles and documents

C-3 NOVEL TRITERPENONE WITH C-28 REVERSE AMIDE DERIVATIVES AS HIV INHIBITORS

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Page/Page column 71, (2016/11/21)

Formula (I) The invention relates to C-3 novel triterpenone with C-28 reverse amide derivatives, related compounds, and pharmaceutical compositions useful for the therapeutic treatment of viral diseases and particularly HIV mediated diseases.

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