Benthiocarb

Benthiocarb
Names
	IUPAC name S-(4-Chlorobenzyl) diethylcarbamothioate
	Other names Thiobencarb, Saturn, Bolero
Identifiers
CAS Number	28249-77-6 ;
3D model (JSmol)	Interactive image;
ChEMBL	ChEMBL388559 ;
ChemSpider	31512 ;
ECHA InfoCard	100.044.461
KEGG	C14428 ;
PubChem CID	34192;
UNII	90LN6Y7I7H ;
CompTox Dashboard (EPA)	DTXSID6024337 ;
	InChI InChI=1S/C12H16ClNOS/c1-3-14(4-2)12(15)16-9-10-5-7-11(13)8-6-10/h5-8H,3-4,9H2,1-2H3 Key: QHTQREMOGMZHJV-UHFFFAOYSA-N ; InChI=1S/C12H16ClNOS/c1-3-14(4-2)12(15)16-9-10-5-7-11(13)8-6-10/h5-8H,3-4,9H2,1-2H3;
	SMILES Clc1ccc(cc1)CSC(=O)N(CC)CC;
Properties
Chemical formula	C12H16ClNOS
Molar mass	257.78 g·mol−1
Appearance	Pale yellow to brownish-yellow liquid
Density	1.145-1.180 g cm−3 at 20 °C
Melting point	3.3 °C (37.9 °F; 276.4 K)
Boiling point	126 to 129 °C (259 to 264 °F; 399 to 402 K) at 0.008 Torr
Solubility in water	28.0 mg/L at 25 °C
Solubility	Readily soluble in: acetone, ethanol, xylene, methanol, benzene, n-hexane, and acetonitrile
log P	3.42 (octanol/water)[1]
Hazards
NFPA 704 (fire diamond)	1 4 0
Flash point	165.8 °C (330.4 °F; 438.9 K)
	Lethal dose or concentration (LD, LC):
LD50 (median dose)	Rat, oral 1300 mg/kg Mouse, oral 560 mg/kg [2]
	Except where otherwise noted, data are given for materials in their standard state (at 25 °C [77 °F], 100 kPa).
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	Infobox references

Benthiocarb is a thiocarbamate cholinesterase inhibitor used as an herbicide.

References

Tomlin, C.D.S., ed. (1997). The Pesticide Manual - World Compendium (11th ed.). Surrey, England: British Crop Protection Council. p. 1192.
Worthing, C.R. and S.B. Walker, ed. (1987). The Pesticide Manual - A World Compendium (8th ed.). Thornton Heath, UK: The British Crop Protection Council. p. 796.

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