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H9006

Sigma-Aldrich

7-(β-Hydroxyethyl)theophylline

solid

Synonym(s):

1,3-Dimethyl-7-(2-hydroxyethyl)xanthine

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About This Item

Empirical Formula (Hill Notation):
C9H12N4O3
CAS Number:
519-37-9
Molecular Weight:
224.22
EC Number:
208-269-8
MDL number:
MFCD00055055
UNSPSC Code:
41106305
PubChem Substance ID:
24895836
NACRES:
NA.77

form

solid

color

white

solubility

H2O: soluble (Solutions may be stored for several days at 4°C.)
ethanol: moderately soluble (Solutions may be stored for several days at 4°C.)

SMILES string

CN1C(=O)N(C)c2ncn(CCO)c2C1=O

InChI

1S/C9H12N4O3/c1-11-7-6(8(15)12(2)9(11)16)13(3-4-14)5-10-7/h5,14H,3-4H2,1-2H3

InChI key

NWPRCRWQMGIBOT-UHFFFAOYSA-N

Gene Information

human ... ADORA2B(136)

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Application

Useful synthetic intermediate in the preparation of 7-substituted xanthines.

Biochem/physiol Actions

Pharmacological profile similar to theophylline.

pictograms

Exclamation mark
GHS07

signalword

Warning

hcodes

H302

Hazard Classifications

Acute Tox. 4 Oral

Storage Class

11 - Combustible Solids

wgk_germany

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

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E Hashimoto et al.
Biochemical and biophysical research communications, 204(1), 318-324 (1994-10-14)
Adenosine induced by hypoxia exerts various effects via different types of receptors. Recently, hypoxia was shown to be a strong inducer of vascular endothelial growth factor, a secreted endothelial cell specific mitogen. In this report, we studied on effects of
Binding of theophylline, ethophylline and diprophylline to human serum albumin.
M V Alvarez et al.
Il Farmaco; edizione pratica, 43(7-8), 259-265 (1988-07-01)
A Apicella et al.
Biomaterials, 14(2), 83-90 (1993-01-01)
An interpretation of the drug release from monolithic water-swellable and soluble polymer tablets is presented. A convenient parameter, alpha, which compares the drug-diffusive conductance in the gel layer with the swelling and dissolving characteristics of the unpenetrated polymer was used
R Pohloudek-Fabini et al.
Die Pharmazie, 39(1), 24-26 (1984-01-01)
The testing of oxyethyltheophylline solutions for injection involved the separate study of their constituents, theophylline and ethophylline, particular attention being given to the behaviour of both these active agents under thermal stress in acid or alkaline medium. Acids exert little
Susruta Majumdar et al.
AAPS PharmSciTech, 13(3), 853-862 (2012-06-01)
Two different types of derivatives of theophylline (Th-H) incorporating ethyleneoxy groups into the promoiety have been synthesized. One is a soft alkyl type where N-methyl-N-methoxyethyleneoxycarbonylaminomethyl chlorides have been used to alkylate Th-H in the 7 position. The other is in
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