D108
1,3-Dipropyl-7-methylxanthine
solid
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About This Item
Empirical Formula (Hill Notation):
C12H18N4O2
CAS Number:
Molecular Weight:
250.30
UNSPSC Code:
41106305
PubChem Substance ID:
MDL number:
Form:
solid
form
solid
color
white
solubility
0.1 M NaOH: soluble, DMSO: soluble
εmax
9,500 at 273 nm
SMILES string
CCCN1C(=O)N(CCC)c2ncn(C)c2C1=O
InChI
1S/C12H18N4O2/c1-4-6-15-10-9(14(3)8-13-10)11(17)16(7-5-2)12(15)18/h8H,4-7H2,1-3H3
InChI key
QVAYTZAGDQIWMB-UHFFFAOYSA-N
Gene Information
human ... ADORA2A(135), ADORA2B(136)
rat ... Adora1(29290), Adora2a(25369)
Biochem/physiol Actions
Caffeine analog with some selectivity for A2 adenosine receptors.
Storage Class
13 - Non Combustible Solids
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
Eyeshields, Gloves, type N95 (US)
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