2H-Purin-2-one,1,3,6,9-tetrahydro-1,3-dimethyl-8-[[2-(1-piperidinyl)ethyl]thio]-6-thioxo-

Modify Date: 2024-01-19 11:41:31

2H-Purin-2-one,1,3,6,9-tetrahydro-1,3-dimethyl-8-[[2-(1-piperidinyl)ethyl]thio]-6-thioxo- Structure
2H-Purin-2-one,1,3,6,9-tetrahydro-1,3-dimethyl-8-[[2-(1-piperidinyl)ethyl]thio]-6-thioxo- structure
 Common Name 2H-Purin-2-one,1,3,6,9-tetrahydro-1,3-dimethyl-8-[[2-(1-piperidinyl)ethyl]thio]-6-thioxo-
CAS Number 6493-46-5 Molecular Weight 339.47900
Density 1.41g/cm3 Boiling Point 546.2ºC at 760mmHg
Molecular Formula C14H21N5OS2 Melting Point N/A
MSDS N/A Flash Point 284.1ºC

 Names

Name 1,3-dimethyl-8-(2-piperidin-1-ylethylsulfanyl)-6-sulfanylidene-7H-purin-2-one
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.41g/cm3
Boiling Point 546.2ºC at 760mmHg
Molecular Formula C14H21N5OS2
Molecular Weight 339.47900
Flash Point 284.1ºC
Exact Mass 339.11900
PSA 116.24000
LogP 1.84550
Index of Refraction 1.694

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XH6487300
CHEMICAL NAME :
Theophylline, 8-(2-(piperidinoethyl)thio)-6-thio-
CAS REGISTRY NUMBER :
6493-46-5
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C14-H21-N5-O-S2
MOLECULAR WEIGHT :
339.52
WISWESSER LINE NOTATION :
T56 BM DN FNVNYJ F1 H1 IUS CS2- AT6NTJ

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#04457

 Synonyms

Theophylline,8-(2-(piperidinoethyl)thio)-6-thio
Uric acid,1,3-dimethyl-8-(2-(piperidinoethyl)thio)-6-thio
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Chemsrc provides CAS#:6493-46-5 MSDS, density, melting point, boiling point, structure, etc. Its name is 2H-Purin-2-one,1,3,6,9-tetrahydro-1,3-dimethyl-8-[[2-(1-piperidinyl)ethyl]thio]-6-thioxo->> amp version: 2H-Purin-2-one,1,3,6,9-tetrahydro-1,3-dimethyl-8-[[2-(1-piperidinyl)ethyl]thio]-6-thioxo-

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