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3-Methylxanthine

CAS NO.： 1076-22-8

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Product Detail

Properties

3-Methylxanthine

Product Name: 3-METHYLXANTHINE

Synonyms:

3-METHYLXANTHINE;Theophylline-ethylenediamineImpurity2（Theophylline-ethylenediamineEPImpurityB）;AKOSNCG-0058;2,6-DIHYDROXY-3-METHYLPURINE;3-METHYLXATHINEXANTHINEDERIVATIVE;3-METHYLXANTHINECRYSTALLINE

CAS: 1076-22-8

MF: C6H6N4O2

MW: 166.14

Properties

3-methylxanthine, a metabolite of theophylline, is a xanthine derivative with the functions of diuresis, cardiotonic and relaxation of smooth muscle. It is an isomer of theobromine. It can also be used as bronchodilator.

CAS No.

1076-22-8

Formula

C6H6N4O2

Molecular Mass

166.13700

Exact Mass

166.04900

PSA

83.54000

Logp

-1.05010

IUPAC

3-methyl-7H-purine-2,6-dione

Matter Classification

organic

Category

Melting Point

>300 °C(lit.)

Density

1.539 g/cm3

Boiling Point

294.33°C (rough estimate)

Flash Point

148.8ºC

Appearance

white to cream solid

HS Code

29420000

UN No.

DG-Class

Risk Code

22-26/27/28

Safety Label

Xn,T+

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3-Methylxanthine