methyl (2E)-2-(10-chloro-9-methoxy-4,6-dioxo-2,5-diazabicyclo[5.4.0]undeca-7,9,11-trien-3-ylidene)acetate
Names
[ CAS No. ]:
35514-34-2
[ Name ]:
methyl (2E)-2-(10-chloro-9-methoxy-4,6-dioxo-2,5-diazabicyclo[5.4.0]undeca-7,9,11-trien-3-ylidene)acetate
[Synonym ]:
7-Methoxy-8-butoxytetrazolo<a>chinazol-5-on
Chemical & Physical Properties
[ Density]:
1.464g/cm3
[ Boiling Point ]:
535.5ºC at 760 mmHg
[ Molecular Formula ]:
C13H11ClN2O5
[ Molecular Weight ]:
310.69000
[ Flash Point ]:
277.6ºC
[ Exact Mass ]:
310.03600
[ PSA ]:
101.25000
[ LogP ]:
0.11300
[ Index of Refraction ]:
1.616
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- AF8990000
- CHEMICAL NAME :
- Acetic acid, (8-chloro-3,5-dioxo-7-methoxy-1,3,4,5-tetrahydro-2H-1 ,4-benzodiazepin-2- ylidene)-, methyl ester
- CAS REGISTRY NUMBER :
- 35514-34-2
- BEILSTEIN REFERENCE NO. :
- 0842049
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C13-H11-Cl-N2-O5
- MOLECULAR WEIGHT :
- 310.71
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LDLo - Lowest published lethal dose
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 1 gm/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 14,1233,1971