7-(2-diethoxyphosphoryloxyethyl)-1,3-dimethyl-purine-2,6-dione

Modify Date: 2025-09-13 17:06:31

7-(2-diethoxyphosphoryloxyethyl)-1,3-dimethyl-purine-2,6-dione Structure
7-(2-diethoxyphosphoryloxyethyl)-1,3-dimethyl-purine-2,6-dione structure
 Common Name 7-(2-diethoxyphosphoryloxyethyl)-1,3-dimethyl-purine-2,6-dione
CAS Number 69387-73-1 Molecular Weight 392.30200
Density 1.43g/cm3 Boiling Point 538.6ºC at 760 mmHg
Molecular Formula C13H21N4O8P Melting Point N/A
MSDS N/A Flash Point 279.5ºC

 Names

Name 2-(1,3-dimethyl-2,6-dioxopurin-7-yl)ethyl diethyl phosphate

 Chemical & Physical Properties

Density 1.43g/cm3
Boiling Point 538.6ºC at 760 mmHg
Molecular Formula C13H21N4O8P
Molecular Weight 392.30200
Flash Point 279.5ºC
Exact Mass 392.11000
PSA 134.85000
LogP 0.49460
Index of Refraction 1.595
InChIKey XMRCZTXSSJRABQ-UHFFFAOYSA-N
SMILES CCOP(=O)(OCC)OCCn1cnc2c1c(=O)n(C)c(=O)n2C

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
TC0862600
CHEMICAL NAME :
Phosphoric acid, diethyl ester, ester with 2-(1,2,3,6-tetrahydro-1,3-dimethyl-2,6- dioxopurin-7-yl)ethyl ester
CAS REGISTRY NUMBER :
69387-73-1
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C13-H21-N4-O6-P
MOLECULAR WEIGHT :
360.35
WISWESSER LINE NOTATION :
T56 BN DN FNVNVJ B2OPO&O2&O2 F1 H1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
155 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
APFRAD Annales Pharmaceutiques Francaises. (SPPIF, B.P.22, F-41353 Vineuil, France) V.1- 1943- Volume(issue)/page/year: 36,341,1978
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Chemsrc provides CAS#:69387-73-1 MSDS, density, melting point, boiling point, structure, etc. Its name is 7-(2-diethoxyphosphoryloxyethyl)-1,3-dimethyl-purine-2,6-dione>> amp version: 7-(2-diethoxyphosphoryloxyethyl)-1,3-dimethyl-purine-2,6-dione

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