37893-02-0

Name FLUBENDAZOLE
CAS 37893-02-0
EINECS(EC#) 253-703-1
Molecular Formula C16H12FN3O3
MDL Number MFCD00871999
Molecular Weight 313.28
MOL File 37893-02-0.mol
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Chemical Properties

Appearance Crystalline Solid
Melting point  260°C
Boiling point  313.2±52.0 °C(Predicted)
density  1.4917 (estimate)
Fp  >100 °C
storage temp.  0-6°C
form  neat
pka -9.17±0.20(Predicted)
Usage An anthelmintic
Merck  13,4145
Henry's Law Constant 2.3×1010 mol/(m3Pa) at 25℃, MacBean (2012)
Major Application agriculture
environmental
InChI 1S/C17H10F6N4S/c18-16(19,20)25-13-14(26-17(21,22)23)28-15(24-11-7-3-1-4-8-11)27(13)12-9-5-2-6-10-12/h1-10H/b24-15-,25-13+,26-14-
InChIKey IZFZCMFMJKDHJZ-BANPTERESA-N
SMILES FC(F)(F)/N=C1S\C(=N/c2ccccc2)N(c3ccccc3)C\1=N\C(F)(F)F
CAS DataBase Reference 37893-02-0(CAS DataBase Reference)
EPA Substance Registry System Flubenzimine (37893-02-0)

Safety Data

Hazard Codes  Xi,N
Risk Statements 
R36:Irritating to the eyes.
R50/53:Very Toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment .
Safety Statements 
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S60:This material and/or its container must be disposed of as hazardous waste .
S61:Avoid release to the environment. Refer to special instructions safety data sheet .
RIDADR  UN3077 9/PG 3
WGK Germany  3
RTECS  CY1202500
Storage Class 6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
Hazard Classifications Acute Tox. 3 Inhalation
Aquatic Acute 1
Aquatic Chronic 1
Eye Irrit. 2
Toxicity
LD50 orally in rats: 3750 mg/kg (Bluett, Wainwright)

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