Provenance

Reference data from EU CLP Annex VI and published regulations — verify against your supplier's SDS before use.

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Substance profile

Theophylline

Theophylline is a white, crystalline alkaloid and is odorless.

CAS 58-55-9 C7H8N4O2 180.16 g/mol Danger

01 · Identification

What Theophylline is

Theophylline is a white, crystalline alkaloid and is odorless. Its molecular formula is C7H8N4O2 and its molecular weight is 180.16 g/mol. It melts at 274 °C.

Under the GHS it carries the signal word Danger.

CAS number58-55-9
EC number200-385-7
Index number613-342-00-6
Molecular formulaC7H8N4O2
Molecular weight180.16 g/mol

Other names for Theophylline

  • 1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione

02 · GHS classification

Hazards and label elements

Harmonised classification under CLP Annex VI. This is the legally binding classification in the EU; other jurisdictions may differ.

Signal wordDanger
Hazard statements assigned to Theophylline
CodeHazard statement
H360D May damage the unborn child.

Precautionary statements: P201, P280, P308, P313

This page lists only the codes assigned to Theophylline. The full reference lives on the hazard statements hub, the precautionary statements hub and the GHS pictograms hub.

03 · Physical and chemical properties

Theophylline properties

Every value is shown with the conditions it was measured under and the source it came from. Where sources disagree, all values are listed rather than one being picked — the difference is usually a different form of the substance, not an error.

Property Value Conditions Source
Melting point 274 °C (525.2 °F) HSDB
273.06 °C (523.5 °F) range, midpoint shown CAMEO
272 °C (521.6 °F) range, midpoint shown ICSC
Density g/cm³ ICSC
Solubility Slightly soluble in water HSDB
Slightly soluble in ethanol, ether, chloroform HSDB
In water, 7,360 mg/L at 25 °C at 25 °C HSDB
Vapor pressure negligible ICSC

Values compiled from PubChem Laboratory Chemical Safety Summary. Temperatures converted to Fahrenheit for reference.

04 · Handling and storage

Storing and handling Theophylline

Storage conditions

Store at 20 deg -25 °C (68 deg - 77 °F); excursions permitted between 15 deg - 30 °C (59 deg - 86 °F).

Source: Hazardous Substances Data Bank (HSDB)

Incompatible materials

Incompatible materials: Strong oxidizing agents.

Source: Hazardous Substances Data Bank (HSDB)

Reactivity

THEOPHYLLINE neutralizes acids in exothermic reactions to form salts plus water. May be incompatible with isocyanates, halogenated organics, peroxides, phenols (acidic), epoxides, anhydrides, and acid halides. Flammable gaseous hydrogen may be generated in combination with strong reducing agents, such as hydrides.

Source: CAMEO Chemicals

Planning storage for a mix of chemicals? Check Theophylline in the storage compatibility matrix →

Safety Data Sheet

Getting an SDS for Theophylline

A Safety Data Sheet is written for a product, not for a substance: the supplier of the grade you actually buy issues it, so two suppliers of Theophylline issue two different sheets. That is why there is no single authoritative SDS for a substance to download — what there is, is the job of collecting the sheets for the products you hold and keeping them current as suppliers revise them.

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