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1114-71-2

1114-71-2 structural image
Product Name: PEBULATE
Formula: C10H21NOS
Synonyms: Propyl ethyl-n-butylthiolcarbamate
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Pebulate is a colorless to yellow liquid with aromatic odor. Non corrosive. Used as an herbicide.
Color/Form Colorless or yellow liquid
Odor Aromatic odor
Boiling Point 142 °C at 20 mm Hg
Flash Point 124 °F (OPEN CUP)
Solubility Very soluble in acetone, benzene, methanol
Density 0.9458 at 30 °C/4 °C
Vapor Pressure 0.08 [mmHg]
LogP log Kow = 3.83
Stability/Shelf Life At 40 °C in water, 50% loss occurs in 11 days at less than pH 4 to less than pH 10; Stable at less than 200 °C
Decomposition When heated to decomposition it emits highly toxic fumes of /sulfur and nitrogen oxides/.
Corrosivity Noncorrosive
Refractive Index Index of refraction: 1.4752 at 30 °C/D
Kovats Retention Index 1446 1481.9 1454 1471.7
Other Experimental Properties Amber liquid. BP: 142 °C at 21 mm Hg. Density: 0.9552 g/mL at 20 °C. log Kow = 9.6X10+3 at 25 °C. VP: 8.9C10-3 mm Hg at 25 °C. /Technical/
Chemical Classes Pesticides -> Herbicides, Thiocarbamate

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07

Environment
GHS09
GHS Hazard Statements H302:Acute toxicity,oral
H411:Hazardous to the aquatic environment, long-term hazard
Precautionary Statement Codes P264:Wash hands thoroughly after handling.
P264:Wash skin thouroughly after handling.
P270:Do not eat, drink or smoke when using this product.
P273:Avoid release to the environment.
P391:Collect spillage. Hazardous to the aquatic environment
P301+P312:IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell.
P501:Dispose of contents/container to..…

COMPUTED DESCRIPTORS

Molecular Weight 203.35 g/mol
XLogP3 3.8
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 7
Exact Mass 203.13438547 g/mol
Monoisotopic Mass 203.13438547 g/mol
Topological Polar Surface Area 45.6 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 139
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Pebulate is a colorless to yellow liquid with aromatic odor. Non corrosive. Used as an herbicide.