4H-1-Benzopyran-8-acetic acid, 4-oxo-2-phenyl-, 2-(diethylamino)ethyl ester,hydrochloride
Names
[ CAS No. ]:
87626-57-1
[ Name ]:
4H-1-Benzopyran-8-acetic acid, 4-oxo-2-phenyl-, 2-(diethylamino)ethyl ester,hydrochloride
[Synonym ]:
2-(N,N-diethylamino)-5-bromopyrimidine
2-(N,N-diethylamino)ethyl-4-oxo-2-phenyl-4H-1-benzopyran-8-acetate hydrochloride
5-BROMO-2-(DIETHYLAMINO)PYRIMIDINE
Chemical & Physical Properties
[ Boiling Point ]:
533ºC at 760mmHg
[ Molecular Formula ]:
C23H26ClNO4
[ Molecular Weight ]:
415.91000
[ Flash Point ]:
276.1ºC
[ Exact Mass ]:
415.15500
[ PSA ]:
59.75000
[ LogP ]:
4.68950
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- DJ2107000
- CHEMICAL NAME :
- 4H-1-Benzopyran-8-acetic acid, 4-oxo-2-phenyl-, 2-(diethylamino)ethyl ester, hydrochloride
- CAS REGISTRY NUMBER :
- 87626-57-1
- LAST UPDATED :
- 198910
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C23-H25-N-O4.Cl-H
- MOLECULAR WEIGHT :
- 415.95
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 :
- 586 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- EJMCA5 European Journal of Medicinal Chemistry--Chimie Therapeutique. (Editions Scientifiques Elsevier, 29 rue Buffon, F-75005, Paris, France) V.9- 1974- Volume(issue)/page/year: 20,393,1985