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76-06-2

76-06-2 structural image
Product Name: Trichloronitromethane
Formula: CCl3NO2
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Chloropicrin appears as a slightly oily colorless to yellow liquid with a strong irritating odor. Noncombustible. Denser than water. Vapors are poisonous by inhalation and irritate eyes, nose, and throat.
Color/Form Slightly oily liquid
Odor Intensely irritating tear gas odor
Boiling Point 234 °F at 760 mmHg (NTP, 1992)
Melting Point -92.6 °F (NTP, 1992)
Solubility 1 to 5 mg/mL at 72 °F (NTP, 1992)
Density 1.64 at 77 °F (USCG, 1999) - Denser than water; will sink
Vapor Density 5.7 (NTP, 1992) - Heavier than air; will sink (Relative to Air)
Vapor Pressure 16.9 mmHg at 68 °F ; 40 mmHg at 92.8 °F (NTP, 1992)
LogP log Kow = 2.09
Henry's Law Constant Henry's Law constant = 2.05X10-3 atm-cu m/mol at 25 °C
Stability/Shelf Life Relatively Stable
Decomposition When heated to decomposition it emits very toxic fumes of /hydrogen chloride and nitrogen oxides/.
Corrosivity RELATIVELY INERT CHEMICALLY & NON-CORROSIVE TO COPPER, BRASS & BRONZE BUT ATTACKS IRON, ZINC & OTHER LIGHT METALS
Heat of Vaporization LATENT HEAT OF VAPORIZATION: 57.3 CAL/G
Odor Threshold Odor Threshold Low: 1.1 [mmHg] Odor threshold from CHEMINFO
Refractive Index Index of refraction: 1.4611 at 20 °C/D; 1.4596 at 25 °C/D
Kovats Retention Index 761.3 761
Other Experimental Properties Conversion factors: 1 mg/L = 148.8 ppm, 1 ppm = 6.72 mg/cu m
Chemical Classes Pesticides -> Fumigants

SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Skull and Crossbones
Acute Toxicity
GHS06
GHS Hazard Statements H302:Acute toxicity,oral
H315:Skin corrosion/irritation
H319:Serious eye damage/eye irritation
H330:Acute toxicity,inhalation
H335:Specific target organ toxicity, single exposure;Respiratory tract irritation
Precautionary Statement Codes P260:Do not breathe dust/fume/gas/mist/vapours/spray.
P284:Wear respiratory protection.
P310:Immediately call a POISON CENTER or doctor/physician.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

COMPUTED DESCRIPTORS

Molecular Weight 164.37 g/mol
XLogP3 2.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 0
Exact Mass 162.899461 g/mol
Monoisotopic Mass 162.899461 g/mol
Topological Polar Surface Area 45.8 Ų
Heavy Atom Count 7
Formal Charge 0
Complexity 79.9
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

Chloropicrin appears as a slightly oily colorless to yellow liquid with a strong irritating odor. Noncombustible. Denser than water. Vapors are poisonous by inhalation and irritate eyes, nose, and throat.