6-ethylsulfonyl-7H-purine

Names

[ CAS No. ]:
82499-11-4

[ Name ]:
6-ethylsulfonyl-7H-purine

[Synonym ]:
6-(Ethylsulfonyl)purine
6-Aethansulfonyl-7(9)H-purin
PC 100B
Purine,6-(ethylsulfonyl)
6-ethanesulfonyl-7(9)H-purine

Chemical & Physical Properties

[ Density]:
1.67g/cm3

[ Boiling Point ]:
371.3ºC at 760 mmHg

[ Molecular Formula ]:
C7H8N4O2S

[ Molecular Weight ]:
212.22900

[ Flash Point ]:
178.4ºC

[ Exact Mass ]:
212.03700

[ PSA ]:
96.98000

[ LogP ]:
1.22730

[ Index of Refraction ]:
1.748

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UO8532000
CHEMICAL NAME :
Purine, 6-(ethylsulfonyl)-
CAS REGISTRY NUMBER :
82499-11-4
BEILSTEIN REFERENCE NO. :
0018536
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C7-H8-N4-O2-S
MOLECULAR WEIGHT :
212.25

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Parenteral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
106 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JPMSAE Journal of Pharmaceutical Sciences. (American Pharmaceutical Assoc., 2215 Constitution Ave., NW, Washington, DC 20037) V.50- 1961- Volume(issue)/page/year: 71,618,1982

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 9H-Purine,6-(ethylthio)-

DownStream

Related Compounds

  • 6-octylsulfanyl-7H-purine
  • 6-tetradecoxy-7H-purine
  • 6-cyanopurine
  • 6-(fluoromethyl)-7H-purine
  • 6-methylselanyl-7H-purine
  • 6-methylsulfinyl-7H-purine
  • Tert-butyl 2-(4-chloro-2-formylphenoxy)acetate
  • 1-benzyl 3-methyl (3R,6S)-rel-6-methylpiperidine-1,3-dicarboxylate
  • 2-(1-(tert-Butoxycarbonyl)-4-oxopiperidin-3-yl)acetic acid
  • Ethyl 3-methylpiperidine-4-carboxylate
  • 1-((Benzyloxy)carbonyl)-3-ethyl-4-oxopiperidine-3-carboxylic acid
  • Methyl 4-amino-2-(dimethylamino)-1,3-thiazole-5-carboxylate
  • 1-(4-methylbenzyl)-1H-2,1-benzothiazin-4(3H)-one 2,2-dioxide
  • 2-(4-methoxyphenyl)pyrazolo[1,5-a]pyrazin-4(5H)-one
  • 6-(4-Ethoxyphenyl)pyridazine-3-thiol
  • 6-(3-methoxyphenyl)pyridazine-3(2H)-thione
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