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Carbosulfan Structure

Carbosulfan

Chemical Properties

Melting point <25 °C
Boiling point approximate 126℃
Density  1.0560
vapor pressure  3.1 x 10-5 Pa (20 °C)
refractive index  1.6360 (estimate)
Flash point 96 °C
storage temp.  0-6°C
solubility  Chloroform (Slightly), Methanol (Slightly)
form  Liquid
Water Solubility  0.3 mg l-1 (25 °C)
pka 3.15±0.70(Predicted)
color  Light brown to brown
Merck  13,1836
Major Application agriculture
environmental
InChI 1S/C20H32N2O3S/c1-6-8-13-22(14-9-7-2)26-21(5)19(23)24-17-12-10-11-16-15-20(3,4)25-18(16)17/h10-12H,6-9,13-15H2,1-5H3
InChIKey JLQUFIHWVLZVTJ-UHFFFAOYSA-N
SMILES CCCCN(CCCC)SN(C)C(=O)Oc1cccc2CC(C)(C)Oc12
LogP 6.050 (est)
CAS DataBase Reference 55285-14-8(CAS DataBase Reference)
NIST Chemistry Reference Carbamic acid, [(dibutylamino)thio]methyl-, 2,3-dihydro-2,2-dimethyl-7-benzofuranyl ester(55285-14-8)
EPA Substance Registry System Carbosulfan (55285-14-8)

Safety Information

Hazard Codes  T;N,N,T,T+
Risk Statements  23/25-43-50/53-26-25
Safety Statements  24-37-38-45-60-61-63-36/37-28
RIDADR  UN 2810
WGK Germany  3
RTECS  EZ3815000
HazardClass  6.1(b)
PackingGroup  III
Storage Class 6.1A - Combustible acute toxic Cat. 1 and 2
very toxic hazardous materials
Hazard Classifications Acute Tox. 1 Inhalation
Acute Tox. 3 Oral
Aquatic Acute 1
Aquatic Chronic 1
Skin Sens. 1
Toxicity LD50 in male, female rats (mg/kg): 250, 185 orally; in male, female rabbits (mg/kg): >2000, >2000 dermally; in pheasant, mallard, quail (ppm): 26.2, 8.1, 81.6 orally. LC50 (96 hr) in bluegill, trout (ppb): 14.9, 42.4 (Maitlen).

Usage And Synthesis