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C102

8-Cyclopentyl-1,3-dimethylxanthine

Name: 8-Cyclopentyl-1,3-dimethylxanthine
Brand: SIGMA

≥98% (HPLC), powder

Synonym(s):

8-Cyclopentyltheophylline, CPT

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About This Item

Empirical Formula (Hill Notation):

C₁₂H₁₆N₄O₂

CAS Number:

35873-49-5

Molecular Weight:

248.28

NACRES:

NA.77

PubChem Substance ID:

24277730

UNSPSC Code:

12352200

MDL number:

MFCD00055116

Assay:

≥98% (HPLC)

Form:

powder

Quality level:

100

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Properties

Quality Level

100

assay

≥98% (HPLC)

form

powder

color

white to off-white

solubility

H₂O: slightly soluble <0.28 mg/mL, 45% (w/v) aq 2-hydroxypropyl-β-cyclodextrin: 0.77 mg/mL, DMSO: ~16 mg/mL at 60 °C, 0.1 M NaOH: soluble

SMILES string

CN1C(=O)N(C)c2nc([nH]c2C1=O)C3CCCC3

InChI

1S/C12H16N4O2/c1-15-10-8(11(17)16(2)12(15)18)13-9(14-10)7-5-3-4-6-7/h7H,3-6H2,1-2H3,(H,13,14)

InChI key

SCVHFRLUNIOSGI-UHFFFAOYSA-N

Gene Information

human ... ADORA1(134)

Description

Biochem/physiol Actions

Selective A₁ adenosine receptor antagonist.

Features and Benefits

This compound is featured on the Adenosine Receptors page of the Handbook of Receptor Classification and Signal Transduction. To browse other handbook pages, click here.

Storage Class

11 - 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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