N-acetyl-N-(4-bromophenyl)acetamide
Impurity reference standard
- CAS number
- 78560-01-7
- InChIKey
- NXKKTHQSZSBZML-UHFFFAOYSA-N
- Molecular formula
- C10H10BrNO2
- Molecular weight
- 256.10
- Exact mass
- 254.9895 Da
- Purity
- 95%+
About N-acetyl-N-(4-bromophenyl)acetamide
N-acetyl-N-(4-bromophenyl)acetamide is supplied as an analytical reference standard. It is registered under CAS number 78560-01-7.
The compound is characterised by its molecular formula C10H10BrNO2 and a molecular weight of 256.10, with the two-dimensional structure shown above.
Computed from the structure, the compound has a monoisotopic mass of 254.9895 Da, a calculated LogP of 2.35, a topological polar surface area of 37.38 Ų. It presents 0 hydrogen-bond donors and 2 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.
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)
- 2.35
- Topological polar surface area
- 37.38 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Rings
- 1
- Elemental composition
- Br 31.20% · C 46.90% · H 3.94% · N 5.47% · O 12.49%
Frequently asked questions
What purity does N-acetyl-N-(4-bromophenyl)acetamide ship at?
N-acetyl-N-(4-bromophenyl)acetamide is supplied at 95%+, as stated on the certificate of analysis issued with each pack.
Does N-acetyl-N-(4-bromophenyl)acetamide 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 N-acetyl-N-(4-bromophenyl)acetamide uniquely identified?
The InChIKey NXKKTHQSZSBZML-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 N-acetyl-N-(4-bromophenyl)acetamide?
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 N-acetyl-N-(4-bromophenyl)acetamide?
Standard packs run from milligram to gram quantities and ship from stock. Larger or custom synthesis requirements are quoted on request.
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.