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165611-02-9

165611-02-9 structure
165611-02-9 structure

Name 5-(methylsulfanylmethyl)-7-phenyl-[1,2]oxazolo[4,5-d]pyrimidine-3-carboxamide
Synonyms Isoxazolo(4,5-d)pyrimidine-3-carboxamide,5-((methylthio)methyl)-7-phenyl
3-Carbamido-5-(methylthiomethyl)-7-phenylisoxazolo(4,5-d)pyrimidine
5-((Methylthio)methyl)-7-phenylisoxazolo(4,5-d)pyrimidine-3-carboxamide
Density 1.385g/cm3
Boiling Point 501.1ºC at 760mmHg
Molecular Formula C14H12N4O2S
Molecular Weight 300.33600
Flash Point 256.8ºC
Exact Mass 300.06800
PSA 121.19000
LogP 3.13090
Vapour Pressure 3.59E-10mmHg at 25°C
Index of Refraction 1.678

CHEMICAL IDENTIFICATION

RTECS NUMBER :
NY3402676
CHEMICAL NAME :
Isoxazolo(4,5-d)pyrimidine-3-carboxamide, 5-((methylthio)methyl)-7-phenyl-
CAS REGISTRY NUMBER :
165611-02-9
LAST UPDATED :
199606
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C14-H12-N4-O2-S
MOLECULAR WEIGHT :
300.36

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
>2 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
FRMCE8 Farmaco. (Societa Chimica Italiana, Corso Strada Nova, 86, Casella Postale 227, 27100 Pavia, Italy) V.44- 1989- Volume(issue)/page/year: 50,183,1995