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Substance
ID:184249
Structure
Similarity
Functional Group
Text
ID:162
Theophylline
Sigma Aldrich
ID: T1633
Names and Identifiers
Synonyms
2,6-Dihydroxy-1,3-dimethylpurine
3,7-Dihydro-1,3-dimethyl-1H-purine-2,6-dione
1,3-Dimethylxanthine
Theophylline
IUPAC name
1,3-dimethyl-2,3,6,9-tetrahydro-1H-purine-2,6-dione
IUPAC Traditional name
constant-T
Registration numbers
CAS Number
58-55-9
Beilstein Number
13463
MDL Number
MFCD00079619
EC Number
200-385-7
PubChem SID
24277677
Properties
Safety Information
Risk Statements
22
European Hazard Symbols
Harmful (Xn)
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Faceshields, Gloves
German water hazard class
1
GHS Pictograms
Acute toxicity (oral, dermal, inhalation), categories 1,2,3
RTECS
XH3850000
GHS Precautionary statements
P301+P310
RID/ADR
UN 2811 6.1/PG 3
Packing Group
3
GHS Hazard statements
H301
UN Number
2811
Hazard Class
6.1
GHS Signal Word
Danger
Physical Property
Solubility
0.1 M HCl: soluble
ethanol: moderately soluble
0.1 M NaOH: soluble
H2O: slightly soluble
Apperance
white powder
Product Information
Grade
anhydrous
Purity
≥99%
Pharmacology Properties
Gene Information
human ... ADORA1(134), ADORA2A(135), ADORA2B(136), ADORA3(140), PDE3A(5139), PDE4B(5142)mouse ... Adora2b(11541)rat ... Adora1(29290), Adora2a(25369), Adora2b(29316), Pde1b(29691), Pde3a(50678)
Molecule Details
Biochem/physiol Actions
Phosphodiesterase inhibitor; diuretic; cardiac stimulant; muscle relaxant; asthma medication.
Molecular Spectra
No Data Available
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References
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