6-amino-7-methyl-1H-purine-2-thione

Names

[ CAS No. ]:
104802-77-9

[ Name ]:
6-amino-7-methyl-1H-purine-2-thione

[Synonym ]:
2H-Purine-2-thione,1,7-dihydro-6-amino-7-methyl
2-thio-6-amino-7-methylpurine
2-Thio-7-methyladenine
1,7-Dihydro-6-amino-7-methyl-2H-purine-2-thione

Chemical & Physical Properties

[ Density]:
1.78g/cm3

[ Boiling Point ]:
271.6ºC at 760mmHg

[ Molecular Formula ]:
C6H7N5S

[ Molecular Weight ]:
181.21800

[ Flash Point ]:
118.1ºC

[ Exact Mass ]:
181.04200

[ PSA ]:
108.42000

[ LogP ]:
0.81540

[ Vapour Pressure ]:
0.00637mmHg at 25°C

[ Index of Refraction ]:
1.9

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UP0762100
CHEMICAL NAME :
2H-Purine-2-thione, 1,7-dihydro-6-amino-7-methyl-
CAS REGISTRY NUMBER :
104802-77-9
LAST UPDATED :
198906
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C6-H7-N5-S
MOLECULAR WEIGHT :
181.24

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
590 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
PCJOAU Pharmaceutical Chemistry Journal (English Translation). Translation of KHFZAN. (Plenum Pub. Corp., 233 Spring St., New York, NY 10013) No.1- 1967- Volume(issue)/page/year: 20,493,1986

Synthetic Route

Click to get detail synthetic route

Related Compounds

  • 6-amino-9-cyclopentyl-1H-purine-2-thione
  • 2,8-Dihydroxyadenine
  • 2-THIOADENOSINE
  • Istradefylline
  • 4-Desmethyl Istradefylline
  • Cyclopenta[5,6]naphtho[1,2-c]pyran-2(1H)-one, tetradecahydro-7,4a,6a-trimethyl-7-[(trimethylsilyl)oxy]-, (4aS,4bS,6aS,7R,9aS,9bR,11aS)-
  • 3,6,9-Triazaspiro[5.5]undecan-6-ium
  • Pentacyclo[4.2.0.02,5.03,8.04,7]octane-1-acetic acid, 2-thioxo-1(2H)-pyridinyl ester
  • 2-Anilinocyclopentanecarboxylic acid
  • (1R,2R)-2-amino-1-methylcyclohexanol
  • 2-Acetyl-3-phenylphenol
  • 2-(1-Hydroxyethyl)benzenebutanoic acid methyl ester
  • 4-(4-Hydroxybutylsulfanyl)benzenesulfonamide
  • N-Isobutyl 4-(aminomethyl)benzamide
  • 4-[(4-Hydroxybutyl)sulfonyl]benzenesulfonamide
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