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Product Overview

Product Code

TRC-A627750

CAS Number

317-34-0

Product Format

Neat

Molecular Formula

2 C7 H8 N4 O2 . C2 H8 N2

Molecular Weight

420.43

API Family

Aminophylline

Product Categories

TRC, Pharmaceutical Toxicology Reference Materials , API Reference Standards & Research Materials

Product Type

API

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Product Information

Chemical Data

Analyte Name

Theophylline-Ethylenediamine Anhydrous

CAS Number

317-34-0

Molecular Formula

2 C7 H8 N4 O2 . C2 H8 N2

Molecular Weight

420.43

Accurate Mass

420.1982

SMILES

CN1C(=O)N(C)c2nc[nH]c2C1=O.CN3C(=O)N(C)c4nc[nH]c4C3=O.NCCN

InChI

InChI=1S/2C7H8N4O2.C2H8N2/c2*1-10-5-4(8-3-9-5)6(12)11(2)7(10)13;3-1-2-4/h2*3H,1-2H3,(H,8,9);1-4H2

IUPAC

1,3-dimethyl-7H-purine-2,6-dione;ethane-1,2-diamine

Product Data

Storage Temperature

+20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Transport Restrictions

Air Excepted Air Dangerous

Product Format

Neat

API Family

Aminophylline

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