9H-Purine,6-(propylthio)-

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Names

[ CAS No. ]:
6288-93-3

[ Name ]:
9H-Purine,6-(propylthio)-

[Synonym ]:
6-propylmercapto-7(9)H-purine
6-n-propylthiopurine
6-Propyl-MP
6-Propylmercapto-7(9)H-purin
1H-Purine,6-(propylthio)
QA 71
Purine,6-(propylthio)
6-(Propylthio)purine
6-Propylmercaptopurine

Chemical & Physical Properties

[ Density]:
1.42g/cm3

[ Boiling Point ]:
315.5ºC at 760 mmHg

[ Molecular Formula ]:
C8H10N4S

[ Molecular Weight ]:
194.25700

[ Flash Point ]:
144.6ºC

[ Exact Mass ]:
194.06300

[ PSA ]:
79.76000

[ LogP ]:
1.85500

[ Index of Refraction ]:
1.722

MSDS

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UO9082000
CHEMICAL NAME :
Purine, 6-(propylthio)-
CAS REGISTRY NUMBER :
6288-93-3
LAST UPDATED :
198910
DATA ITEMS CITED :
4
MOLECULAR FORMULA :
C8-H10-N4-S
MOLECULAR WEIGHT :
194.28

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 :
92880 ug/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
NCISP* National Cancer Institute Screening Program Data Summary, Developmental Therapeutics Program. (Bethesda, MD 20205) Volume(issue)/page/year: JAN1986
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Parenteral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
120 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 ** REPRODUCTIVE DATA **
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Oral
DOSE :
100 mg/kg
SEX/DURATION :
female 7 day(s) after conception
TOXIC EFFECTS :
Reproductive - Fertility - post-implantation mortality (e.g. dead and/or resorbed implants per total number of implants)
REFERENCE :
JRPFA4 Journal of Reproduction and Fertility. (Biochemical Soc. Book Depot, POB 32, Commerce Way, Colchester, Essex CO2 8HP, UK) V.1- 1960- Volume(issue)/page/year: 4,291,1962
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Intraperitoneal
DOSE :
100 mg/kg
SEX/DURATION :
female 7-8 day(s) after conception
TOXIC EFFECTS :
Reproductive - Fertility - post-implantation mortality (e.g. dead and/or resorbed implants per total number of implants)
REFERENCE :
JRPFA4 Journal of Reproduction and Fertility. (Biochemical Soc. Book Depot, POB 32, Commerce Way, Colchester, Essex CO2 8HP, UK) V.1- 1960- Volume(issue)/page/year: 4,291,1962

Synthetic Route

Precursor & DownStream

Precursor

  • 6-Mercaptopurine
  • 1-Bromopropane
  • 1-Propanethiol
  • 6-chloropurine

DownStream

  • 6-(Propylsulfonyl)purine

Related Compounds

  • 9H-Purine,6-(cyclopentylthio)-
  • 9H-Purine,6-[(2-thienylmethyl)thio]-
  • 9H-Purine-6-carboximidamide,N-hydroxy-9-b-D-ribofuranosyl-
  • 9H-Purine-6-carboxaldehyde,hydrazone
  • 9H-Purine-6-thiol,2-amino-9-(6-ethyl-6-thio-b-D-ribofuranosyl)- (8CI)
  • 9H-Purine,6-(4-morpholinyl)-9-b-D-ribofuranosyl-
  • 2-(Ethylcarbamoyl)-5-(methoxymethyl)pyridine-3-carboxylic acid
  • 7,7-dimethyl-2H,3H,4H,7H,8H,9H-pyrano[3,2-g]indole
  • Tert-butyl3-(isothiocyanatomethyl)azetidine-1-carboxylate
  • tert-butyl N-[(4-fluorophenyl)methyl]-N-[(2-hydroxy-1,3-benzothiazol-6-yl)methyl]carbamate
  • (1R)-2-amino-1-(1-cyclobutyl-1H-pyrazol-4-yl)ethan-1-ol
  • (1S)-2-amino-1-(1-cyclobutyl-1H-pyrazol-4-yl)ethan-1-ol
  • 8,9-Diazatricyclo[4.3.0.0,2,4]nona-1(9),6-diene-2-carboxylic acid
  • 4-Methyl-3-(1,4-thiazepan-4-yl)cyclohexan-1-one
  • 4-(2-Methyl-5-oxocyclohexyl)-1lambda6-thiomorpholine-1,1-dione
  • 3-(1,2,5-Dithiazepan-5-yl)-4-methylcyclohexan-1-one
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