Acetophenone, 2-nitrilo-3,4,5-trimethoxy-
Names
[ CAS No. ]:
5955-75-9
[ Name ]:
Acetophenone, 2-nitrilo-3,4,5-trimethoxy-
[Synonym ]:
2-Nitrilo-3',4',5'-trimethoxyacetophenone
3.4.5-Trimethoxy-phenylglyoxylsaeure-nitril
3,4,5-Trimethoxy-benzoylcyanid
3,4,5-Trimethoxyphenylglyoxylonitril
ACETOPHENONE,2-NITRILO-3',4',5'-TRIMETHOXY
Chemical & Physical Properties
[ Density]:
1.187g/cm3
[ Boiling Point ]:
354.7ºC at 760 mmHg
[ Molecular Formula ]:
C11H11NO4
[ Molecular Weight ]:
221.20900
[ Flash Point ]:
154.9ºC
[ Exact Mass ]:
221.06900
[ PSA ]:
68.55000
[ LogP ]:
1.41868
[ Index of Refraction ]:
1.515
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- AM9550000
- CHEMICAL NAME :
- Acetophenone, 2-nitrilo-3',4',5'-trimethoxy-
- CAS REGISTRY NUMBER :
- 5955-75-9
- BEILSTEIN REFERENCE NO. :
- 2699129
- LAST UPDATED :
- 199612
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C11-H11-N-O4
- MOLECULAR WEIGHT :
- 221.23
- WISWESSER LINE NOTATION :
- NCVR CO1 DO1 EO1
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 :
- 65 mg/kg
- TOXIC EFFECTS :
- Behavioral - altered sleep time (including change in righting reflex)
- 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: 7,178,1964
Safety Information
[ HS Code ]:
2926909090
Synthetic Route
Precursor & DownStream
Precursor
DownStream
Customs
[ HS Code ]: 2926909090
[ Summary ]:
HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%