8.08158

N-Allylthiourea

for synthesis

• Synonym(s): N-Allylthiourea, Thiosinamine
• Empirical Formula (Hill Notation): C₄H₈N₂S
• CAS Number: 109-57-9
• Molecular Weight: 116.18
• UNSPSC Code: 12352111
• EC Index Number: 203-683-5
• NACRES: NA.22
• MDL number: MFCD00004940
• Assay: ≥98.0% (HPLC)
• Form: powder

Properties

• Quality Segment: 200
• assay: ≥98.0% (HPLC)
• form: powder
• potency: 200 mg/kg LD₅₀, oral (Rat)
• mp: 70-73 °C
• solubility: 66 g/L
• bulk density: 550 kg/m³
• storage temp.: 2-30°C
• SMILES string: S=C(NCC=C)N
• InChI: 1S/C4H8N2S/c1-2-3-6-4(5)7/h2H,1,3H2,(H3,5,6,7)
• InChI key: HTKFORQRBXIQHD-UHFFFAOYSA-N

Description

Application

• Zn dendrite suppression and solid electrolyte interface control using N-allylthiourea as an electrolyte additive for aqueous Zn-ion batteries: The study highlights the effectiveness of N-allylthiourea as an additive for electrolytes in zinc-ion batteries to improve performance and safety (Source).
• Design, synthesis, and spectral characterization of series of thiocarbamides with coumarin backbone: This research synthesizes a series of thiocarbamides including N-allylthiourea, exploring their spectral properties and potential pharmaceutical applications (Source).

Analysis Note

Assay (HPLC, area%): ≥ 98.0 % (a/a)
Identity (IR): passes test

Safety Information

• pictograms: GHS06
• signalword: Danger
• hcodes: H301
• pcodes: P264 - P270 - P301 + P310 - P405 - P501
• Hazard Classifications: Acute Tox. 3 Oral
• Storage Class: 6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects
• wgk: WGK 3
• flash_point_f: Not applicable
• flash_point_c: Not applicable