8-ethylsulfanyl-3,7-dihydropurine-2,6-dione

Modify Date: 2025-08-27 19:57:33

8-ethylsulfanyl-3,7-dihydropurine-2,6-dione Structure
8-ethylsulfanyl-3,7-dihydropurine-2,6-dione structure
 Common Name 8-ethylsulfanyl-3,7-dihydropurine-2,6-dione
CAS Number 73840-29-6 Molecular Weight 212.22900
Density 1.84g/cm3 Boiling Point N/A
Molecular Formula C7H8N4O2S Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 8-ethylsulfanyl-3,7-dihydropurine-2,6-dione
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.84g/cm3
Molecular Formula C7H8N4O2S
Molecular Weight 212.22900
Exact Mass 212.03700
PSA 119.70000
LogP 0.05150
Index of Refraction 1.843
InChIKey SYTLDXNPGBQYRC-UHFFFAOYSA-N
SMILES CCSc1nc2[nH]c(=O)[nH]c(=O)c2[nH]1

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
ZD8099500
CHEMICAL NAME :
Xanthine, 8-(ethylthio)-
CAS REGISTRY NUMBER :
73840-29-6
BEILSTEIN REFERENCE NO. :
0212370
LAST UPDATED :
199706
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C7-H8-N4-O2-S
MOLECULAR WEIGHT :
212.25
WISWESSER LINE NOTATION :
T56 BM DN FMVMVJ CS2

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 :
56 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#02449

 Synthetic Route

Diethyl sulfate structure

Diethyl sulfate

CAS#:64-67-5

1H-Purine-2,6-dione,3,7,8,9-tetrahydro-8-thioxo- structure

1H-Purine-2,6-d...

CAS#:2476-54-2

~%

8-ethylsulfanyl-3,7-dihydropurine-2,6-dione Structure

8-ethylsulfanyl...

CAS#:73840-29-6

Literature: Biltz; Beck Journal fuer Praktische Chemie (Leipzig), 1928 , vol. <2>118, p. 161

 Precursor & DownStream

Precursor  2

DownStream  0

 Synonyms

8-Aethylmercapto-3,7-dihydro-purin-2,6-dion
8-ethylmercapto-3,7-dihydro-purine-2,6-dione
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Chemsrc provides CAS#:73840-29-6 MSDS, density, melting point, boiling point, structure, etc. Its name is 8-ethylsulfanyl-3,7-dihydropurine-2,6-dione>> amp version: 8-ethylsulfanyl-3,7-dihydropurine-2,6-dione

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