Gatifloxacin Related Compound D(3-Desmethyl Gatifloxacin)
Impurity reference standard
- CAS number
- 112811-57-1
- InChIKey
- XJCSNIFKGXSDGN-UHFFFAOYSA-N
- Molecular formula
- C18H20FN3O4
- Molecular weight
- 361.37
- Exact mass
- 361.1438 Da
- Purity
- 95%+
- Appearance
- Light Yellow Solid
- Storage
- 2℃ ~ 8℃
About Gatifloxacin Related Compound D(3-Desmethyl Gatifloxacin)
Gatifloxacin Related Compound D(3-Desmethyl Gatifloxacin) is supplied as an analytical reference standard. It is registered under CAS number 112811-57-1.
The compound is characterised by its molecular formula C18H20FN3O4 and a molecular weight of 361.37, with the two-dimensional structure shown above.
Computed from the structure, the compound has a monoisotopic mass of 361.1438 Da, a calculated LogP of 1.59, a topological polar surface area of 83.80 Ų. It presents 2 hydrogen-bond donors and 5 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)
- 1.59
- Topological polar surface area
- 83.80 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Rings
- 4
- Elemental composition
- C 59.83% · F 5.26% · H 5.58% · N 11.63% · O 17.71%
Frequently asked questions
What purity does Gatifloxacin Related Compound D(3-Desmethyl Gatifloxacin) ship at?
Gatifloxacin Related Compound D(3-Desmethyl Gatifloxacin) is supplied at 95%+, as stated on the certificate of analysis issued with each pack.
Does Gatifloxacin Related Compound D(3-Desmethyl Gatifloxacin) 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 Gatifloxacin Related Compound D(3-Desmethyl Gatifloxacin) uniquely identified?
The InChIKey XJCSNIFKGXSDGN-UHFFFAOYSA-N identifies the structure unambiguously, so it can be matched against your own registry or a public database.
Is a structure file available for Gatifloxacin Related Compound D(3-Desmethyl Gatifloxacin)?
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 Gatifloxacin Related Compound D(3-Desmethyl Gatifloxacin)?
Standard packs run from milligram to gram quantities and ship from stock. Larger or custom synthesis requirements are quoted on request.
How should Gatifloxacin Related Compound D(3-Desmethyl Gatifloxacin) 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.