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1-Heptyl-2-thiourea, an organic thiourea derivative, is a chemical compound characterized by the molecular formula C10H21N2S. It features a heptyl chain attached to the nitrogen atom, which contributes to its unique properties and potential applications.

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  • 3098-03-1 Structure
  • Basic information

    1. Product Name: 1-HEPTYL-2-THIOUREA
    2. Synonyms: 1-HEPTYL-2-THIOUREA
    3. CAS NO:3098-03-1
    4. Molecular Formula: C8H18N2S
    5. Molecular Weight: 174.31
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 3098-03-1.mol
  • Chemical Properties

    1. Melting Point: 90°C
    2. Boiling Point: 259.2°Cat760mmHg
    3. Flash Point: 110.6°C
    4. Appearance: /
    5. Density: 0.978g/cm3
    6. Vapor Pressure: 0.0131mmHg at 25°C
    7. Refractive Index: 1.513
    8. Storage Temp.: N/A
    9. Solubility: N/A
    10. CAS DataBase Reference: 1-HEPTYL-2-THIOUREA(CAS DataBase Reference)
    11. NIST Chemistry Reference: 1-HEPTYL-2-THIOUREA(3098-03-1)
    12. EPA Substance Registry System: 1-HEPTYL-2-THIOUREA(3098-03-1)
  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: IRRITANT
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 3098-03-1(Hazardous Substances Data)

3098-03-1 Usage

Uses

Used in Corrosion Inhibition:
1-Heptyl-2-thiourea is used as a corrosion inhibitor for metal surfaces, particularly in industrial and marine applications. It serves to form a protective film on the metal surface, thereby preventing corrosion and extending the lifespan of the material.
Used in Pharmaceutical Research:
1-Heptyl-2-thiourea is studied for its potential anti-cancer properties, as it may exhibit activity against certain types of cancer. Further research is necessary to fully understand its potential applications in this field.
Used in Anti-Inflammatory Research:
1-HEPTYL-2-THIOUREA is also being investigated for its possible anti-inflammatory properties, which could make it a candidate for the development of new treatments for inflammatory conditions.
Used in Antimicrobial Applications:
1-Heptyl-2-thiourea has shown the ability to inhibit the growth of certain bacteria and fungi, making it a potential candidate for use in antimicrobial agents and treatments.

Check Digit Verification of cas no

The CAS Registry Mumber 3098-03-1 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 3,0,9 and 8 respectively; the second part has 2 digits, 0 and 3 respectively.
Calculate Digit Verification of CAS Registry Number 3098-03:
(6*3)+(5*0)+(4*9)+(3*8)+(2*0)+(1*3)=81
81 % 10 = 1
So 3098-03-1 is a valid CAS Registry Number.
InChI:InChI=1/C8H18N2S/c1-2-3-4-5-6-7-10-8(9)11/h2-7H2,1H3,(H3,9,10,11)

3098-03-1SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 14, 2017

Revision Date: Aug 14, 2017

1.Identification

1.1 GHS Product identifier

Product name 1-Heptyl-2-thiourea

1.2 Other means of identification

Product number -
Other names heptylthiourea

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:3098-03-1 SDS

3098-03-1Downstream Products

3098-03-1Relevant articles and documents

Substituted 5,5′-diphenyl-2-thioxoimidazolidin-4-one as CB 1 cannabinoid receptor ligands: Synthesis and pharmacological evaluation

Muccioli, Giulio G.,Martin, Diana,Scriba, Gerhard K. E.,Poppitz, Wolfgang,Poupaert, Jacques H.,Wouters, Johan,Lambert, Didier M.

, p. 2509 - 2517 (2007/10/03)

A set of 30 substituted 5,5′-diphenyl-2-thioxoimidazolidin-4-one (thiohydantoins) derivatives was synthesized, and their affinity for the human CB1 cannabinoid receptor has been evaluated. These compounds are derived from the previously described cannabinoid ligands 5,5′- diphenylimidazolidine-2,4-dione (hydantoins). The replacement of the oxygen by a sulfur leads to an increase of the affinity while the function-i.e., inverse agonism-determined by [35S]-GTPγS experiments remains unaffected. Finally, to evaluate the molecular parameters that could influence the affinity of the thiohydantoins, molecular electrostatic potential as well as lipophilicity calculations were undertaken on representative thiohydantoins and hydantoins derivatives. In conclusion, 5,5′-bis-(4-iodophenyl)-3-butyl-2- thioxoimidazolidin-4-one (31) and 3-allyl-5,5′-bis(4-bromophenyl)-2- thioxoimidazolidin-4-one (32) possess the highest affinity for the CB 1 cannabinoid receptor described to date for the hydantoin and thiohydantoins series when compared in a same bioassay.

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