1.02446

Chloroform-D1

deuteration degree min. 99.95% for NMR spectroscopy MagniSolv^™

• Synonym(s): Chloroform-D1, Deuterochloroform
• Empirical Formula (Hill Notation): CCl₃D
• CAS Number: 865-49-6
• Molecular Weight: 120.38
• MDL number: MFCD00000827
• UNSPSC Code: 12142201
• EC Index Number: 212-742-4
• NACRES: NA.22

Properties

• vapor pressure: 211 hPa ( 20 °C)
• Quality Level: 200
• isotopic purity: ≥99.95 atom % D
• form: liquid
• potency: 695 mg/kg LD₅₀, oral (Rat); >3980 mg/kg LD₅₀, skin (Rabbit)
• technique(s): NMR: suitable
• impurities: ≤0.005% Water (HO) (NMR)
• bp: 60 °C/1013 hPa
• mp: -64.1 °C
• density: 1.50 g/cm³ at 20 °C
• storage temp.: 2-8°C
• SMILES string: ClC(Cl)(Cl)[2H]
• InChI: 1S/CHCl3/c2-1(3)4/h1H/i1D
• InChI key: HEDRZPFGACZZDS-MICDWDOJSA-N

Description

General description

A wide range of MagniSolv deuterated solvents with extremely low residual water, excellent chemical purity, and the highest isotopic enrichment available can satisfy the most demanding requirements of researchers. Depending on application and sensitivity of the NMR spectrometer our offer solvents with deuteration degrees between 98% and 99.96%. In case of all the water soluble deuterated standard products, water content is specified according to both Karl Fischer and NMR.

Application

• Extraction of alkaloids for NMR-based profiling: exploratory analysis of an archaic Cinchona bark collection.: This study explores the methods of extracting alkaloids for NMR profiling, highlighting the application of Chloroform-D1 in the chemical analysis process to ensure accurate and detailed spectroscopy results. The research was conducted using an archaic Cinchona bark collection, providing insights into the historical and analytical applications of Chloroform-D1 in academic settings (Yilmaz et al., 2012).

Analysis Note

Deuteration degree: ≥ 99.95 %
Water (NMR, HO): ≤ 0.005 %
Performance test (NMR-spectrum): passes test

Other Notes

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Legal Information

MAGNISOLV is a trademark of Merck KGaA, Darmstadt, Germany

Safety Information

• Pictograms: GHS06,GHS08
• Signal Word: Danger
• Hazard Statements: H302 - H315 - H319 - H331 - H336 - H351 - H361d - H372
• Precautionary Statements: P202 - P301 + P312 - P302 + P352 - P304 + P340 + P311 - P305 + P351 + P338 - P308 + P313
• Hazard Classifications: Acute Tox. 3 Inhalation - Acute Tox. 4 Oral - Carc. 2 - Eye Irrit. 2 - Repr. 2 - Skin Irrit. 2 - STOT RE 1 Oral - STOT SE 3
• Target Organs: Central nervous system
• Storage Class Code: 6.1D - Non-combustible, acute toxic Cat.3 / toxic hazardous materials or hazardous materials causing chronic effects
• WGK: WGK 3
• Flash Point(F): does not flash
• Flash Point(C): does not flash