69722
3-Methylxanthine
purum, ≥98.0% (HPLC)
Synonym(s):
2,6-Dihydroxy-3-methylpurine
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About This Item
Empirical Formula (Hill Notation):
C6H6N4O2
CAS Number:
Molecular Weight:
166.14
EC Number:
214-058-1
UNSPSC Code:
12352100
PubChem Substance ID:
Beilstein/REAXYS Number:
180944
MDL number:
grade
purum
assay
≥98.0% (HPLC)
mp
>300 °C (lit.)
SMILES string
CN1C(=O)NC(=O)c2[nH]cnc12
InChI
1S/C6H6N4O2/c1-10-4-3(7-2-8-4)5(11)9-6(10)12/h2H,1H3,(H,7,8)(H,9,11,12)
InChI key
GMSNIKWWOQHZGF-UHFFFAOYSA-N
Gene Information
rat ... Adora1(29290), Adora2a(25369)
Packaging
Bottomless glass bottle. Contents are inside inserted fused cone.
Other Notes
Metabolite of theophylline - HPLC determination
Storage Class
11 - Combustible Solids
wgk
WGK 1
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
dust mask type N95 (US), Eyeshields, Gloves
Regulatory Information
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B B Rasmussen et al.
Analytical biochemistry, 222(1), 9-13 (1994-10-01)
A method for the quantitation of three metabolites of theophylline, 1-methylxanthine (1 MX), 3-methylxanthine (3MX), and 1,3-dimethyluric acid (13DMU) in human liver microsomes has been developed. The method is based on a simple one-step extraction followed by isocratic, reversed-phase high-performance
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