(E)-2-cyano-3-[3-ethoxy-4-hydroxy-5-[(2,3,4,5,6-pentafluorophenyl)sulfanylmethyl]phenyl]prop-2-enamide

Modify Date: 2024-01-14 15:32:45

(E)-2-cyano-3-[3-ethoxy-4-hydroxy-5-[(2,3,4,5,6-pentafluorophenyl)sulfanylmethyl]phenyl]prop-2-enamide Structure
(E)-2-cyano-3-[3-ethoxy-4-hydroxy-5-[(2,3,4,5,6-pentafluorophenyl)sulfanylmethyl]phenyl]prop-2-enamide structure
Common Name (E)-2-cyano-3-[3-ethoxy-4-hydroxy-5-[(2,3,4,5,6-pentafluorophenyl)sulfanylmethyl]phenyl]prop-2-enamide
CAS Number 107787-93-9 Molecular Weight 444.37500
Density 1.52g/cm3 Boiling Point 559.7ºC at 760mmHg
Molecular Formula C19H13F5N2O3S Melting Point N/A
MSDS N/A Flash Point 292.3ºC

 Names

Name (E)-2-cyano-3-[3-ethoxy-4-hydroxy-5-[(2,3,4,5,6-pentafluorophenyl)sulfanylmethyl]phenyl]prop-2-enamide

 Chemical & Physical Properties

Density 1.52g/cm3
Boiling Point 559.7ºC at 760mmHg
Molecular Formula C19H13F5N2O3S
Molecular Weight 444.37500
Flash Point 292.3ºC
Exact Mass 444.05700
PSA 122.63000
LogP 5.32068
Vapour Pressure 3.91E-13mmHg at 25°C
Index of Refraction 1.597

 Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UC6316193
CHEMICAL NAME :
2-Propenamide, 2-cyano-3-(3-ethoxy-4-hydroxy-5-(((pentafluorophenyl) thio)methyl)phenyl)-
CAS REGISTRY NUMBER :
107787-93-9
LAST UPDATED :
199806
DATA ITEMS CITED :
1

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
1 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
USXXAM United States Patent Document. (U.S. Patent Office, Box 9, Washington, DC 20231) Volume(issue)/page/year: #4853403

 Precursor & DownStream

Precursor  2

DownStream  0