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5545-70-0

4-(1,3-benzodioxol-5-ylmethyl)-N-(propan-2-yl)piperazine-1-carbothioamide is a complex organic compound with the molecular formula C18H22N2O2S. It is characterized by a piperazine ring, which is a heterocyclic compound containing two nitrogen atoms in a six-membered ring. The molecule features a benzodioxole group, which is a benzene ring with two oxygen atoms forming a dioxolane ring fused to it, and a propan-2-yl group, which is an isopropyl group. The compound also includes a carbothioamide functional group, indicating the presence of a thioamide (a sulfur analog of an amide). This chemical structure suggests potential applications in pharmaceuticals or as a chemical intermediate due to its unique arrangement of functional groups.

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  • 5545-70-0 Structure

  • Basic information

    1. Product Name: 4-(1,3-benzodioxol-5-ylmethyl)-N-(propan-2-yl)piperazine-1-carbothioamide
    2. Synonyms: 1-piperazinecarbothioamide, 4-(1,3-benzodioxol-5-ylmethyl)-N-(1-methylethyl)-; 4-(1,3-Benzodioxol-5-ylmethyl)-N-isopropylpiperazine-1-carbothioamide
    3. CAS NO:5545-70-0
    4. Molecular Formula: C16H23N3O2S
    5. Molecular Weight: 321.4377
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 5545-70-0.mol

  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 425.4°C at 760 mmHg
    3. Flash Point: 211.1°C
    4. Appearance: N/A
    5. Density: 1.239g/cm3
    6. Vapor Pressure: 1.91E-07mmHg at 25°C
    7. Refractive Index: 1.612
    8. Storage Temp.: N/A
    9. Solubility: N/A
    10. CAS DataBase Reference: 4-(1,3-benzodioxol-5-ylmethyl)-N-(propan-2-yl)piperazine-1-carbothioamide(CAS DataBase Reference)
    11. NIST Chemistry Reference: 4-(1,3-benzodioxol-5-ylmethyl)-N-(propan-2-yl)piperazine-1-carbothioamide(5545-70-0)
    12. EPA Substance Registry System: 4-(1,3-benzodioxol-5-ylmethyl)-N-(propan-2-yl)piperazine-1-carbothioamide(5545-70-0)

  • 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: 5545-70-0(Hazardous Substances Data)

5545-70-0 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 5545-70-0 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 5,5,4 and 5 respectively; the second part has 2 digits, 7 and 0 respectively.
Calculate Digit Verification of CAS Registry Number 5545-70:
(6*5)+(5*5)+(4*4)+(3*5)+(2*7)+(1*0)=100
100 % 10 = 0
So 5545-70-0 is a valid CAS Registry Number.

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