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D108

Sigma-Aldrich

1,3-Dipropyl-7-methylxanthine

solid

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About This Item

Empirical Formula (Hill Notation):
C12H18N4O2
CAS Number:
31542-63-9
Molecular Weight:
250.30
MDL number:
MFCD00055219
UNSPSC Code:
41106305
PubChem Substance ID:
24278401

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 Code

13 - Non Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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