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Molekula

Molekula

Aprepitant

SKU 90028467 CAS 170729-80-3 C23H21F7N4O3 MW 534.43 In stock Bulk quantities on request

Supplying 4,500+ customers in over 80 countries

ISO 9001:2015 & ISO 14001:2015 certified · Supplying laboratories and industry since 2000 · Listed pack sizes are a starting point — we manufacture, source and repack to the quantity you need

Aprepitant is a selective neurokinin-1 (NK1) receptor antagonist used primarily in antiemetic therapy to prevent chemotherapy-induced nausea and vomiting, as well as postoperative nausea. It is also approved for the prevention of delayed nausea and vomiting associated with highly emetogenic cancer therapy. Aprepitant has a CAS number of 170729-80-3, with the molecular formula C23H21F7N4O3 and a molecular weight of 534.43. It must be stored at -15 to -20°C and carries a signal word of Warning. Molekula supplies Aprepitant from research to bulk quantities with full documentation and ISO 9001:2015 traceability.

Expect a response within hours Speak to a chemist: +44 (0) 3302 000333

Example image for illustration only. Other packaging and pack sizes are available.

Pricing & pack sizes

Pack sizes & pricing

These pack sizes aren't a limit. Molekula manufactures, sources and repacks to order — if you need 500 kg and only see 1 kg listed, . We quote from grams to multi-tonne.

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  • 1 g — £123.90 per pack ex VAT · £148.68 inc. VAT

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Specifications

Property Value
Appearance White or off-white crystalline powder
Impurity A ≤0.15%
Specific rotation +67° - +73°
Heavy metals ≤0.001%
Impurity C ≤0.1%
Loss on Drying ≤0.5%
Assay 98.0% - 102.0%
Methanol ≤0.3%
Residue on Ignition ≤0.1%
Total Impurities ≤0.5%
Diethyl Ether ≤0.5%

Storage & handling

Property Value
Storage Temperature -15 to -20 °C
Transport Class 9
Packing Group III
Acidity Neutral

For research use only. Not for human use.

Identification

Property Value
SKU 90028467
CAS Number 170729-80-3
IUPAC Name 3-[[(2R,3S)-2-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)morpholin-4-yl]methyl]-1,4-dihydro-1,2,4-triazol-5-one
Molecular Formula C23H21F7N4O3
Molecular Weight 534.43
Exact Mass 534.1502
SMILES C[C@H](C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)O[C@@H]2[C@@H](N(CCO2)CC3=NNC(=O)N3)C4=CC=C(C=C4)F
InChIKey ATALOFNDEOCMKK-OITMNORJSA-N
InChI InChI=1S/C23H21F7N4O3/c1-12(14-8-15(22(25,26)27)10-16(9-14)23(28,29)30)37-20-19(13-2-4-17(24)5-3-13)34(6-7-36-20)11-18-31-21(35)33-32-18/h2-5,8-10,12,19-20H,6-7,11H2,1H3,(H2,31,32,33,35)/t12-,19+,20-/m1/s1
PubChem CID 135413536
UN Number UN3077
REACH Code Y110
HTS Code 2934.99.44.00
Tariff Code 2934999090

Safety & GHS

Warning
  • GHS pictogram — Health Hazard Health Hazard GHS07
  • GHS pictogram — Serious Health Hazard Serious Health Hazard GHS08
  • GHS pictogram — Hazardous to the Environment Hazardous to the Environment GHS09

Hazard statements

  • H302 Harmful if swallowed
  • H319 Causes serious eye irritation
  • H351 Suspected of causing cancer
  • H361f Suspected of damaging fertility.
  • H373 May cause damage to organs through prolonged or repeated exposure
  • H400 Very toxic to aquatic life

Precautionary statements

  • P201 Obtain special instructions before use
  • P260 Do not breathe dust/fume/gas/mist/vapours/spray
  • P273 Avoid release to the environment
  • P280 Wear protective gloves/protective clothing/eye protection/face protection
  • P305+351+338 IF IN EYES: Rinse with water for several minutes. Remove contact lenses if present and easy to do. Continue rinsing
  • P308+313 IF exposed or concerned: Get medical advice/attention

Documents

Certificate of Analysis (CoA) by batch

Enter a lot or batch number to retrieve the CoA for that specific batch. We can generate one from spec data if no PDF is on file.

Synonyms

  • Aponvie
  • Aprepitant (MK-0869)
  • aprepitantum
  • Cinvanti
  • Emend
  • Emend (TN)
  • eMende
  • L 754,030
  • MK 0869
  • MK 869

Frequently asked questions

What is aprepitant used for?

Aprepitant is primarily used as an antiemetic to prevent nausea and vomiting caused by chemotherapy, radiation therapy, and postoperative recovery.

What is the chemical formula and molecular weight of aprepitant?

The chemical formula is **C₂₃H₂₁F₇N₄O₃**, and the molecular weight is **534.43 g/mol**.

How should aprepitant be stored?

Aprepitant must be stored at **-15 to -20°C** to maintain stability and potency.

What grades or purity levels of aprepitant does Molekula supply?

Molekula supplies aprepitant in **pharmaceutical-grade purity**, suitable for clinical and research applications.

Can Molekula supply aprepitant in bulk quantities?

Yes, Molekula can provide aprepitant in bulk, with quantities tailored to meet customer requirements.

What documentation comes with an order of aprepitant?

Each order includes a **Certificate of Analysis (CoA)**, **Material Safety Data Sheet (MSDS)**, and **batch-specific documentation** for traceability.

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