Substance

ID:356598

Names and Identifiers
Synonyms
咖啡因1,3,7-三甲基黄嘌呤Caffeine1,3,7-Trimethylxanthine
IUPAC Traditional name
caffeine
IUPAC name
1,3,7-trimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione
Registration numbers
MDL Number
Beilstein Number
CAS Number
EC Number
Properties
Safety Information
GHS Pictograms
GHS07
Acute toxicity (oral, dermal, inhalation), category 4
Skin irritation, category 2
Eye irritation, category 2
Skin sensitisation, category 1
Specific Target Organ Toxicity – Single exposure, category 3
MSDS Link
UN Number
1544
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Faceshields, Gloves
Risk Statements
22
GHS Hazard statements
H302
RID/ADR
UN 1544 6.1/PG 3
European Hazard Symbols
Harmful Harmful (Xn)
Packing Group
3
German water hazard class
1
Hazard Class
6.1
GHS Signal Word
Warning
RTECS
EV6475000
Physical Property
Melting Point
234-236.5 °C(lit.)
235-237 °C
Pharmacology Properties
Gene Information
human ... ADORA1(134), PDE4B(5142)
Product Information
Empirical Formula (Hill Notation)
C8H10N4O2
Grade
puriss.
Molecule Details
Biochem/physiol Actions
A central nervous system stimulant believed to act through adenosine receptors and monoamine neurotransmitters. It is an adenosine receptor antagonist and adenosine 3′,5′-cyclic monophosphate (cAMP) phosphodiesterase inhibitor. Thus, levels of cAMP increase in cells following treatment with caffeine. It has been reported to affect cellular calcium levels, releasing calcium from intracellular stores. It overrides the cell cycle effects of various chemicals such as protease inhibitors, preventing apoptosis; and it has been shown to inhibit cellular DNA repair mechanisms.
Molecular Spectra
No Data Available
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References
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