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Bioactive Small Molecules

3-Isobutyl-1-methylxanthine, 99%+

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Buy 3-Isobutyl-1-methylxanthine, 99%+ (CAS 28822-58-4) from Zemixal. Lab and bulk packs, batch COA, fast global delivery.

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3-Isobutyl-1-methylxanthine, 99%+ chemical structure
CAS number28822-58-4
FormulaC10H14N4O2
Molar mass222.24 g/mol
Physical formPowder
HS code29420090
Purity≥99%
InChIKeyAPIXJSLKIYYUKG-UHFFFAOYSA-N
IUPAC name1-methyl-3-(2-methylpropyl)-7H-purine-2,6-dione

About 3-Isobutyl-1-methylxanthine, 99%+

3-Isobutyl-1-methylxanthine, 99%+ is part of the Zemixal bioactive Small Molecules range. For your records (≥99%), the material is defined by CAS 28822-58-4, formula C10H14N4O2 and molar mass 222.24 g/mol. It is described as white to off-white powder.

Use cases we see most often

  • Cell signalling research
  • Pharmacological screening
  • Target validation

Handling and storage

Store at 2–8 °C. Literature values: melting point 200-201 °C and density 1.3 g/cm3. It carries the GHS signal word Warning (H302), so wear gloves and eye protection and work with good ventilation.

Standard pack sizes are 100 mg, 250 mg, 1 g, 5 g and 25 g, and custom quantities are quoted on request. You receive a batch certificate of analysis and a 16-section SDS with each order. Request pricing online and we confirm availability, documentation and freight to your country.

Typical uses

  • Cell signalling research
  • Pharmacological screening
  • Target validation

Applications

Specifications and identifiers

Specifications of 3-Isobutyl-1-methylxanthine, 99%+
Product name3-Isobutyl-1-methylxanthine, 99%+
Catalogue numberZX-002744
CAS number28822-58-4
IUPAC name1-methyl-3-(2-methylpropyl)-7H-purine-2,6-dione
Molecular formulaC10H14N4O2
Molar mass222.24 g/mol
Exact mass222.1117
Purity / assay≥99%
Physical formPowder
AppearanceWhite to off-white powder
Melting point200-201 °C
Density1.3 g/cm3
XLogP31.5
H-bond donors / acceptors1 / 3
Topological polar surface area69.3 Ų
Storage2–8 °C
HS code29420090
InChIKeyAPIXJSLKIYYUKG-UHFFFAOYSA-N
SMILESCC(C)CN1C2=C(C(=O)N(C1=O)C)NC=N2
PubChem CID3758
Synonyms3-Isobutyl-1-methylanxthine, Methylisobutylxanthine, MIX, IBMX, isobutylmethylxanthine, 1H-Purine-2,6-dione, 3,7-dihydro-1-methyl-3-(2-methylpropyl)-, Xanthine, 3-isobutyl-1-methyl-, 3-Isobutyl-1-methyl-3,7-dihydro-1H-purine-2,6-dione, 3-Isobutyl-1-methyxanthine, 3-isobutyl-1-methyl-7H-xanthine, 1-methyl-3-(2-methylpropyl)-3,7-dihydro-1H-purine-2,6-dione, Isobutyltheophylline

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

Safety and GHS hazards

GHS07 Irritant or harmful
Irritant or harmful

Signal word Warning

  • H302Harmful if swallowed

Precautionary statements P264, P270, P301 + P317, P330, P501

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 3-Isobutyl-1-methylxanthine, 99%+
100 mgQuoted on request
250 mgQuoted on request
1 gQuoted on request
5 gQuoted on request
25 gQuoted on request

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

Questions about 3-Isobutyl-1-methylxanthine, 99%+

Which CAS number identifies 3-Isobutyl-1-methylxanthine, 99%+?
3-Isobutyl-1-methylxanthine, 99%+ is registered under CAS 28822-58-4. You may also see it listed as 3-Isobutyl-1-methylanxthine, Methylisobutylxanthine, MIX. Our catalogue number for this item is ZX-002744.
What are the formula and molar mass of 3-Isobutyl-1-methylxanthine, 99%+?
For 3-Isobutyl-1-methylxanthine, 99%+, its formula is C10H14N4O2 and its molar mass is 222.24 g/mol. The systematic (IUPAC) name is 1-methyl-3-(2-methylpropyl)-7H-purine-2,6-dione. InChIKey APIXJSLKIYYUKG-UHFFFAOYSA-N lets you match it in any structure database.
What grade and pack sizes are available for 3-Isobutyl-1-methylxanthine, 99%+?
This listing is ≥99% purity. Standard packs are 100 mg, 250 mg, 1 g, 5 g, 25 g. Larger quantities and custom packing can be quoted on request.
Which documents come with 3-Isobutyl-1-methylxanthine, 99%+?
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 3-Isobutyl-1-methylxanthine, 99%+ to my country?
Yes. Because 3-Isobutyl-1-methylxanthine, 99%+ 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.
How do I store 3-Isobutyl-1-methylxanthine, 99%+?
2–8 °C. Keep the container closed and follow the handling advice in the SDS.

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