4-(2-cyanoethyl)-4-(4-methylbenzoyl)heptanedinitrile
Names
[ CAS No. ]:
7461-85-0
[ Name ]:
4-(2-cyanoethyl)-4-(4-methylbenzoyl)heptanedinitrile
Chemical & Physical Properties
[ Density]:
1.102g/cm3
[ Boiling Point ]:
579.8ºC at 760 mmHg
[ Molecular Formula ]:
C18H19N3O
[ Molecular Weight ]:
293.36300
[ Flash Point ]:
304.5ºC
[ Exact Mass ]:
293.15300
[ PSA ]:
88.44000
[ LogP ]:
4.07544
[ Index of Refraction ]:
1.532
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- MI9275000
- CHEMICAL NAME :
- Heptanedinitrile, 4-(2-cyanoethyl)-4-p-toluoyl-
- CAS REGISTRY NUMBER :
- 7461-85-0
- BEILSTEIN REFERENCE NO. :
- 3386692
- LAST UPDATED :
- 199712
- DATA ITEMS CITED :
- 1
- MOLECULAR FORMULA :
- C18-H19-N3-O
- MOLECULAR WEIGHT :
- 293.40
- WISWESSER LINE NOTATION :
- NC2X2CN&2CN&VR D1
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
- TYPE OF TEST :
- LDLo - Lowest published lethal dose
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 500 mg/kg
- TOXIC EFFECTS :
- Details of toxic effects not reported other than lethal dose value
- REFERENCE :
- CBCCT* "Summary Tables of Biological Tests," National Research Council Chemical-Biological Coordination Center. (National Academy of Science Library, 2101 Constitution Ave., NW, Washington, DC 20418) Volume(issue)/page/year: 9,130,1957
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%