3-Carbamido-5-chloromethyl-7-phenylisoxazolo(4,5-d)pyrimidine

Modify Date: 2024-10-05 10:57:23

3-Carbamido-5-chloromethyl-7-phenylisoxazolo(4,5-d)pyrimidine Structure
3-Carbamido-5-chloromethyl-7-phenylisoxazolo(4,5-d)pyrimidine structure
Common Name 3-Carbamido-5-chloromethyl-7-phenylisoxazolo(4,5-d)pyrimidine
CAS Number 165611-01-8 Molecular Weight 288.68900
Density 1.46g/cm3 Boiling Point 485.7ºC at 760mmHg
Molecular Formula C13H9ClN4O2 Melting Point N/A
MSDS N/A Flash Point 247.6ºC

 Names

Name 5-(chloromethyl)-7-phenyl-[1,2]oxazolo[4,5-d]pyrimidine-3-carboxamide
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.46g/cm3
Boiling Point 485.7ºC at 760mmHg
Molecular Formula C13H9ClN4O2
Molecular Weight 288.68900
Flash Point 247.6ºC
Exact Mass 288.04100
PSA 95.89000
LogP 3.00670
Vapour Pressure 1.38E-09mmHg at 25°C
Index of Refraction 1.671

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
NY3400892
CHEMICAL NAME :
Isoxazolo(4,5-d)pyrimidine-3-carboxamide, 5-(chloromethyl)-7-phenyl-
CAS REGISTRY NUMBER :
165611-01-8
LAST UPDATED :
199606
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C13-H9-Cl-N4-O2
MOLECULAR WEIGHT :
288.71

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

 Synonyms

3-Carbamido-5-chloromethyl-7-phenylisoxazolo(4,5-d)pyrimidine
5-chloromethyl-7-phenyl-isoxazolo[4,5-d]pyrimidine-3-carboxamide
Isoxazolo(4,5-d)pyrimidine-3-carboxamide,5-(chloromethyl)-7-phenyl