Molfinder
Home
Support
About Us
Data Source
Statistics
Blogs
Substance
ID:350553
Structure
Similarity
Functional Group
Text
ID:103456
1,3-Dimethyl-8-phenylxanthine
Sigma Aldrich
ID: P2278
Names and Identifiers
IUPAC Traditional name
8-phenyltheophylline
IUPAC name
1,3-dimethyl-8-phenyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione
Synonyms
8-Phenyltheophylline
1,3-Dimethyl-8-phenylxanthine
Registration numbers
CAS Number
961-45-5
PubChem SID
24278626
Beilstein Number
261704
MDL Number
MFCD00005582
Properties
Safety Information
MSDS Link
Download link
German water hazard class
3
Personal Protective Equipment
Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter
RTECS
UO8445700
Pharmacology Properties
Gene Information
human ... ADORA1(134), ADORA2B(136), ADORA3(140)rat ... Adora1(29290), Adora2a(25369), Adora2b(29316)
Physical Property
Solubility
aqueous base: moderately soluble (Solutions should be stored at 4 °C.)
H2O: slightly soluble
ethanol: moderately soluble (Solutions should be stored at 4 °C.)
Apperance
off-white to light yellow crystalline
Melting Point
>300 °C(lit.)
Product Information
Empirical Formula (Hill Notation)
C13H12N4O2
Potency
86 nM Ki for A1 receptors
Molecule Details
Biochem/physiol Actions
Selective A1 adenosine receptor antagonist.
Packaging
1 g in glass bottle
100 mg in glass bottle
Molecular Spectra
No Data Available
Click here to submit data
References
No Data Available
Click here to submit data
Quote
Download
Navigation
General Information
Names and Identifiers
Registration numbers
Properties
Molecule Details
Molecular Spectra
References