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API Reference Standards

Tofacitinib

Reference StandardAvailable on request

Tofacitinib (CAS 477600-75-2) supplier Zemixal: C16H20N6O, COA and SDS with every lot, worldwide shipping. Catalogue no. ZX-006868.

Pack sizes
Tofacitinib chemical structure
CAS number477600-75-2
FormulaC16H20N6O
Molar mass312.37 g/mol
Physical formSolid
HS code38229090
InChIKeyUJLAWZDWDVHWOW-YPMHNXCESA-N
IUPAC name3-[(3R,4R)-4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]-3-oxopropanenitrile

About Tofacitinib

Analytical teams working on Tofacitinib use Tofacitinib as a qualified comparison standard. For your records (Reference Standard), the material is defined by CAS 477600-75-2, formula C16H20N6O and molar mass 312.37 g/mol. It is handled as a solid.

Typical applications

  • Identification & assay
  • Method development & validation
  • QC reference material

Handling and storage

It carries the GHS signal word Danger (H301, H302, H311 and H315), so wear gloves and eye protection and work with good ventilation.

Order it in 10 mg, 25 mg, 50 mg and 100 mg packs or ask for a bulk quotation. Each lot travels with a certificate of analysis with characterisation data. Add it to your quote list and our team replies with price, lead time and shipping options within one business day.

Reference standards for Tofacitinib

See every impurity, metabolite and related compound we list for this API.

Tofacitinib standards

Typical uses

  • Identification & assay
  • Method development & validation
  • QC reference material

Applications

Specifications and identifiers

Specifications of Tofacitinib
Product nameTofacitinib
Catalogue numberZX-006868
CAS number477600-75-2
Other CAS numbers540737-29-9
IUPAC name3-[(3R,4R)-4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]-3-oxopropanenitrile
Molecular formulaC16H20N6O
Molar mass312.37 g/mol
Exact mass312.1699
GradeReference Standard
Physical formSolid
XLogP31.5
H-bond donors / acceptors1 / 5
Topological polar surface area88.9 Ų
HS code38229090
InChIKeyUJLAWZDWDVHWOW-YPMHNXCESA-N
SMILESC[C@@H]1CCN(C[C@@H]1N(C)C2=NC=NC3=C2C=CN3)C(=O)CC#N
PubChem CID9926791
SynonymsCp-690 free base, CP-690, JAK inhibitors: tofacitinib, Tofacitinib (CP-690550,Tasocitinib), 4oti, rac-Tofacitinib, Tofacitinib (CP-690550), racemic-tofacitinib, racemic-Tasocitinib, Tofacitinib (USAN), Tofacitinib Base, 3eyg

Lot values are stated on the batch certificate of analysis. Ask for a typical COA with your quotation.

Safety and GHS hazards

GHS06 Acute toxicity
Acute toxicity
GHS07 Irritant or harmful
Irritant or harmful
GHS08 Health hazard
Health hazard

Signal word Danger

  • H301Toxic if swallowed
  • H302Harmful if swallowed
  • H311Toxic in contact with skin
  • H315Causes skin irritation
  • H319Causes serious eye irritation
  • H331Toxic if inhaled
  • H335May cause respiratory irritation
  • H351Suspected of causing cancer
  • H360May damage fertility or the unborn child
  • H373May causes damage to organs through prolonged or repeated exposure

Precautionary statements P203, P260, P261, P262, P264, P264 + P265, P270, P271, P280, P301 + P316, P301 + P317, P302 + P352, P304 + P340, P305 + P351 + P338, P316, P318, P319, P321, P330, P332 + P317, P337 + P317, P361 + P364, P362 + P364, P403 + P233

Classification summarised from public GHS notifications. It can vary with grade and concentration, so always follow the SDS supplied with your lot.

Pack sizes

Pack sizes of Tofacitinib
10 mgQuoted on request
25 mgQuoted on request
50 mgQuoted on request
100 mgQuoted on request

Need a different size? Bulk drums and custom packing are quoted on request through the quote form on this page.

Questions about Tofacitinib

Which CAS number identifies Tofacitinib?
Tofacitinib is registered under CAS 477600-75-2. You may also see it listed as Cp-690 free base, CP-690, JAK inhibitors: tofacitinib. Our catalogue number for this item is ZX-006868.
What are the formula and molar mass of Tofacitinib?
For Tofacitinib, its formula is C16H20N6O and its molar mass is 312.37 g/mol. The systematic (IUPAC) name is 3-[(3R,4R)-4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]-3-oxopropanenitrile. InChIKey UJLAWZDWDVHWOW-YPMHNXCESA-N lets you match it in any structure database.
How is Tofacitinib used in pharmaceutical QC?
Tofacitinib is a characterised reference material linked to Tofacitinib. Laboratories use it to identify and quantify this impurity during method development and validation, stability work, batch release testing and regulatory submissions.
What grade and pack sizes are available for Tofacitinib?
This listing is Reference Standard grade. Standard packs are 10 mg, 25 mg, 50 mg, 100 mg. Larger quantities and custom packing can be quoted on request.
Which documents come with Tofacitinib?
Each lot ships with a batch certificate of analysis and a 16-section GHS safety data sheet. A typical COA or specification sheet can be shared with the quotation before you order.
Can Zemixal ship Tofacitinib to my country?
Yes. Because Tofacitinib is classed as hazardous, it travels in UN-approved packaging as dangerous goods under IATA or IMDG rules, with the export paperwork your broker needs.

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