Dabigatran-13C6
Impurity reference standard
- CAS number
- 1210608-88-0
- InChIKey
- YBSJFWOBGCMAKL-WLDHFFRPSA-N
- Molecular formula
- C19[13C]6H25N7O3
- Molecular weight
- 477.47
- Exact mass
- 477.2220 Da
- Purity
- 95%+
- Appearance
- White to Brown Solid
- Storage
- 2℃ ~ 8℃
About Dabigatran-13C6
Dabigatran-13C6 is supplied as an analytical reference standard. It is registered under CAS number 1210608-88-0.
The compound is characterised by its molecular formula C19[13C]6H25N7O3 and a molecular weight of 477.47, with the two-dimensional structure shown above.
Computed from the structure, the compound has a monoisotopic mass of 477.2220 Da, a calculated LogP of 2.99, a topological polar surface area of 150.22 Ų. It presents 4 hydrogen-bond donors and 6 acceptors. These values are commonly used to anticipate chromatographic retention and to plan ionisation conditions during method development.
Each pack ships with a certificate of analysis reporting purity of 95%+ together with the supporting analytical data — HNMR, MS and HPLC or GC traces — so the material can be released straight into your own QC workflow. Recommended storage: 2℃ ~ 8℃.
Available from stock in milligram to gram quantities; larger or custom synthesis requirements are quoted on request.
Calculated properties
Derived from the two-dimensional structure above using RDKit. Computed values describe the parent structure and are provided as a reference for method development — they are not measured data.
- LogP (Crippen)
- 2.99
- Topological polar surface area
- 150.22 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 35
- Rings
- 4
Frequently asked questions
What purity does Dabigatran-13C6 ship at?
Dabigatran-13C6 is supplied at 95%+, as stated on the certificate of analysis issued with each pack.
Does Dabigatran-13C6 come with a certificate of analysis?
Yes. Every pack ships with a certificate of analysis plus the supporting analytical data — HNMR, MS and HPLC or GC traces.
How is Dabigatran-13C6 uniquely identified?
The InChIKey YBSJFWOBGCMAKL-WLDHFFRPSA-N identifies the structure unambiguously, so it can be matched against your own registry or a public database.
Is a structure file available for Dabigatran-13C6?
Yes. The two-dimensional structure is drawn on this page from the SMILES record, and the SMILES or a molfile can be supplied on request.
What pack sizes are available for Dabigatran-13C6?
Standard packs run from milligram to gram quantities and ship from stock. Larger or custom synthesis requirements are quoted on request.
How should Dabigatran-13C6 be stored?
Recommended storage: 2℃ ~ 8℃.
Need this standard, or a related one?
Send the compound name, CAS number or a structure file — we confirm availability, pack size and lead time, usually within one business day.