902322

Caffeine-(trimethyl-¹³C₃)

endotoxin tested, ≥99 atom % ¹³C, ≥99% (CP)

• Empirical Formula (Hill Notation): ¹³C₃C₅H₁₀N₄O₂
• CAS Number: 78072-66-9
• Molecular Weight: 197.17
• MDL number: MFCD01075576
• UNSPSC Code: 12352116

Properties

• isotopic purity: ≥99 atom % ¹³C
• assay: ≥99% (CP)
• form: solid
• technique(s): mass spectrometry (MS): suitable
• mp: 234-236.5 °C (lit.)
• suitability: endotoxin tested
• mass shift: M+3
• SMILES string: [13CH3]N1C(=O)N([13CH3])c2ncn([13CH3])c2C1=O
• InChI: 1S/C8H10N4O2/c1-10-4-9-6-5(10)7(13)12(3)8(14)11(6)2/h4H,1-3H3/i1+1,2+1,3+1
• InChI key: RYYVLZVUVIJVGH-VMIGTVKRSA-N

Description

Application

For R&D use only. Not for drug, household, or other uses. Any other use is the sole responsibility of the end user.

Endotoxin testing is done on the bulk form of the product before subdivision packaging. This bulk test does not guarantee that the subdivision or repackaged aliquot is endotoxin-free when it is received or used by the customer and does not imply suitability for any particular purpose. If the product must be endotoxin-free for the intended application, the product should be tested prior to actual use.

Packaging

This product may be available from bulk stock and can be packaged on demand. For information on pricing, availability and packaging, please contact Stable Isotopes Customer Service.

Safety Information

• pictograms: GHS07
• signalword: Warning
• hcodes: H302
• pcodes: P264 - P270 - P301 + P312 - P501
• Hazard Classifications: Acute Tox. 4 Oral
• Storage Class: 11 - Combustible Solids
• wgk_germany: WGK 1
• flash_point_f: Not applicable
• flash_point_c: Not applicable