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Atomfair 2,2-Dimethylpropanethioamide C5H11NS CAS 630-22-8

2,2-Dimethylpropanethioamide (CAS No. 630-22-8) is a high-purity organic compound with the molecular formula C5H11NS . This thioamide derivative features a 2,2-dimethylpropane backbone, offering unique reactivity for synthetic and research applications. Ideal for use in pharmaceutical intermediates, organic synthesis, and material science, this compound is supplied with comprehensive analytical documentation including1H NMR,13C NMR, and HPLC purity data. Packaged under inert gas to ensure stability, it is available in quantities ranging from milligrams to kilograms to meet both laboratory and pilot-scale needs.

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Description

2,2-Dimethylpropanethioamide (CAS No. 630-22-8) is a high-purity organic compound with the molecular formula C5H11NS. This thioamide derivative features a 2,2-dimethylpropane backbone, offering unique reactivity for synthetic and research applications. Ideal for use in pharmaceutical intermediates, organic synthesis, and material science, this compound is supplied with comprehensive analytical documentation including 1H NMR, 13C NMR, and HPLC purity data. Packaged under inert gas to ensure stability, it is available in quantities ranging from milligrams to kilograms to meet both laboratory and pilot-scale needs.

Properties

  • CAS Number: 630-22-8
  • Complexity: 80.6
  • IUPAC Name: 2,2-dimethylpropanethioamide
  • InChI: InChI=1S/C5H11NS/c1-5(2,3)4(6)7/h1-3H3,(H2,6,7)
  • InChI Key: FJZJUSOFGBXHCV-UHFFFAOYSA-N
  • Exact Mass: 117.06122053
  • Molecular Formula: C5H11NS
  • Molecular Weight: 117.22
  • SMILES: CC(C)(C)C(=S)N
  • Topological: 58.1
  • Monoisotopic Mass: 117.06122053
  • Synonyms: 2,2-dimethylpropanethioamide, 630-22-8, DTXSID00388714, DTXCID60339681, 677-829-5, 2,2-Dimethylthiopropionamide, 2,2,2-Trimethylthioacetamide, MFCD09742834, Dabrafenib related; GW 441956X, Propanethioamide, 2,2-dimethyl-, thiopivalamide, 2,2-dimethyl-thiopropionamide, 2,2-dimethylthio propionamide, SCHEMBL1026012, NIOSH/UE4523000, SCHEMBL12102191, 2-Methyl-2-methylthiopropionamide, FJZJUSOFGBXHCV-UHFFFAOYSA-N, NSC381432, AKOS000150524, Propionamide, 2-methyl-2-methylthio-, FD36176, NSC-381432, AS-10697, SY029105, DB-028038, CS-0044786, UE45230000, EN300-36990, Z278180216

Application

2,2-Dimethylpropanethioamide serves as a versatile building block in organic synthesis, particularly for the preparation of heterocyclic compounds and sulfur-containing analogs. Researchers utilize this compound in medicinal chemistry for the development of novel pharmacophores due to its reactive thioamide group. It is also employed in material science for the synthesis of functionalized polymers and ligands for metal coordination complexes.

Safety and Hazards

GHS Hazard Statements

  • H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
  • H315 (33.3%): Causes skin irritation [Warning Skin corrosion/irritation]
  • H319 (33.3%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]

Precautionary Statements

  • P264, P264+P265, P270, P280, P301+P317, P302+P352, P305+P351+P338, P321, P330, P332+P317, P337+P317, P362+P364, and P501

Hazard Classes and Categories

  • Acute Tox. 4 (100%)
  • Skin Irrit. 2 (33.3%)
  • Eye Irrit. 2 (33.3%)

If you are interested or have any questions, please contact us at support@atomfair.com

Disclaimer: Sold exclusively for laboratory research. Prohibited for commercial use, diagnostics, or human/animal applications. Buyers assume all compliance liability.

Disclaimer

Intended Use & Restrictions

This product is sold exclusively for laboratory research, analytical testing, or non-commercial purposes.

  • Strictly prohibited: Resale, repackaging, or formulation into commercial products.
  • Not approved for human/animal use, diagnostics, or manufacturing (including pharmaceuticals, agrochemicals, or consumer goods).

Patent & Regulatory Compliance

Certain molecules may be protected by active patents or regulatory restrictions.

  • Buyers must independently verify patent status (e.g., via USPTO/EPO/CNIPA) and comply with local laws.
  • Atomfair LLC does not provide legal assurances regarding patent non-infringement or jurisdictional compliance.

Liability Release

By purchasing, the buyer agrees to:

  • Use this product only as permitted by law.
  • Indemnify Atomfair LLC against all claims arising from misuse, patent infringement, or regulatory violations.

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