4-((3,3,3-Trifluoro-2-trifluoromethyl)propenylcarbonyl)benzonitrile

Modify Date: 2024-02-08 07:58:11

4-((3,3,3-Trifluoro-2-trifluoromethyl)propenylcarbonyl)benzonitrile Structure
4-((3,3,3-Trifluoro-2-trifluoromethyl)propenylcarbonyl)benzonitrile structure
Common Name 4-((3,3,3-Trifluoro-2-trifluoromethyl)propenylcarbonyl)benzonitrile
CAS Number 35444-04-3 Molecular Weight 293.16500
Density 1.43g/cm3 Boiling Point 355ºC at 760 mmHg
Molecular Formula C12H5F6NO Melting Point N/A
MSDS N/A Flash Point 168.5ºC

 Names

Name 4-[4,4,4-trifluoro-3-(trifluoromethyl)but-2-enoyl]benzonitrile

 Chemical & Physical Properties

Density 1.43g/cm3
Boiling Point 355ºC at 760 mmHg
Molecular Formula C12H5F6NO
Molecular Weight 293.16500
Flash Point 168.5ºC
Exact Mass 293.02800
PSA 40.86000
LogP 3.79198
Index of Refraction 1.452

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
DI4960000
CHEMICAL NAME :
Benzonitrile, p-(4,4,4-trifluoro-3-trifluoromethylcrotonoyl)-
CAS REGISTRY NUMBER :
35444-04-3
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C12-H5-F6-N-O
MOLECULAR WEIGHT :
293.18
WISWESSER LINE NOTATION :
NCR DV1UYXFFFXFFF

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
56 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#08792

 Safety Information

HS Code 2926909090

 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%
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