145-95-9

145-95-9 structure
145-95-9 structure
  • Name: 6H-Purine-6-thione,1,2,3,9-tetrahydro-, 3-oxide
  • Chemical Name: 3-hydroxy-7H-purine-6-thione
  • CAS Number: 145-95-9
  • Molecular Formula: C5H4N4OS
  • Molecular Weight: 168.17600
  • Create Date: 2016-11-26 22:33:12
  • Modify Date: 2024-01-19 16:46:06

Name 3-hydroxy-7H-purine-6-thione
Synonyms 6-Mercaptopurine oxide
6-Mercaptopurine 3-oxide
Mercaptopurine 3-N-oxide
6-Mercaptopurine 3-N-oxide
6-Mercapto-purin-3-N-oxid
6-Mercapto-purin-3-oxid
FDA 0188
Purin-6-thiol,3-N-oxide
Purine-6-thiol,3-oxide
3-oxy-1,7(9)-dihydro-purine-6-thione
Density 1.93g/cm3
Boiling Point 583.2ºC at 760mmHg
Molecular Formula C5H4N4OS
Molecular Weight 168.17600
Flash Point 306.5ºC
Exact Mass 168.01100
PSA 105.83000
LogP 0.67510
Vapour Pressure 1.91E-14mmHg at 25°C
Index of Refraction 1.945

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UP0525000
CHEMICAL NAME :
Purin-6-thiol, 3-N-oxide
CAS REGISTRY NUMBER :
145-95-9
LAST UPDATED :
198910
DATA ITEMS CITED :
3
MOLECULAR FORMULA :
C5-H4-N4-O-S
MOLECULAR WEIGHT :
168.19
WISWESSER LINE NOTATION :
T56 BM DN FN HNJ FO ISH

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
250 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
ARPAAQ Archives of Pathology. (Chicago, IL) V.5(3)-50(3), 1928-50; V.70-99, 1960-75. For publisher information, see APLMAS. Volume(issue)/page/year: 86,395,1968 ** REPRODUCTIVE DATA **
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Intraperitoneal
DOSE :
100 mg/kg
SEX/DURATION :
female 11 day(s) after conception
TOXIC EFFECTS :
Reproductive - Specific Developmental Abnormalities - craniofacial (including nose and tongue) Reproductive - Specific Developmental Abnormalities - musculoskeletal system Reproductive - Specific Developmental Abnormalities - urogenital system
REFERENCE :
ARPAAQ Archives of Pathology. (Chicago, IL) V.5(3)-50(3), 1928-50; V.70-99, 1960-75. For publisher information, see APLMAS. Volume(issue)/page/year: 86,395,1968
TYPE OF TEST :
TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE :
Intraperitoneal
DOSE :
100 mg/kg
SEX/DURATION :
female 11 day(s) after conception
TOXIC EFFECTS :
Reproductive - Effects on Embryo or Fetus - fetal death
REFERENCE :
ARPAAQ Archives of Pathology. (Chicago, IL) V.5(3)-50(3), 1928-50; V.70-99, 1960-75. For publisher information, see APLMAS. Volume(issue)/page/year: 86,395,1968