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91-08-7

91-08-7 structural image
Product Name: 2-METHYL-M-PHENYLENE DIISOCYANATE
Formula: C9H6N2O2
Synonyms: 2-Methyl-m-phenylene diisocyanate;Tolylene-2,6-diisocyanate
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Toluene-2,6-diisocyanate is a liquid. Used in the manufacture of polyurethane foams, elastomers, and coatings; crosslinking agent for nylon 6. (EPA, 1998)
Color/Form Colorless to yellow liquid ... turns pale yellow on exposure to air
Odor Pungent
Boiling Point 264 to 271 °F at 18 mmHg (EPA, 1998)
Melting Point 68 to 72 °F for a 80% 2,4:20% 2,6 TDI mixture (EPA, 1998)
Flash Point 270 °F for a 80% 2,4:20% 2,6 TDI mixture (EPA, 1998)
Solubility Reaction (NTP, 1992)
Density 1.22 at 77 °F for a 80% 2,4:20% 2,6 TDI mixture (EPA, 1998) - Denser than water; will sink
Vapor Density 6
Vapor Pressure 0.5 mmHg at 77 °F for a 80% 2,4:20% 2,6 TDI mixture (EPA, 1998)
Decomposition When heated to decomposition, it emits highly toxic fumes of ... /nitrogen oxides/.
Polymerization The diisocyanate may undergo exothermic polymerization in contact with bases or more than traces of acyl chlorides, sometimes used as stabilizers. /2,4-Toluene diisocyanate/
Odor Threshold Odor Threshold Low: 0.05 [mmHg] Odor threshold = 50 ppb with about 1/2 of volunteers detecting and identifying the material at 400 ppb
Refractive Index Index of refraction: 1.5708 at 20 °C/D
Other Experimental Properties Conversion factor: mg/cu m = 7.12 X ppm
Chemical Classes Plastics & Rubber -> Diisocyanates

SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Skull and Crossbones
Acute Toxicity
GHS06

Health Hazard
GHS08
GHS Hazard Statements H315:Skin corrosion/irritation
H317:Sensitisation, Skin
H319:Serious eye damage/eye irritation
H330:Acute toxicity,inhalation
H334:Sensitisation, respiratory
H335:Specific target organ toxicity, single exposure;Respiratory tract irritation
H351:Carcinogenicity
H412:Hazardous to the aquatic environment, long-term hazard
Precautionary Statement Codes P202:Do not handle until all safety precautions have been read and understood.
P273:Avoid release to the environment.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352:IF ON SKIN: wash with plenty of soap and water.
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 174.16 g/mol
XLogP3 3.9
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 2
Exact Mass 174.042927438 g/mol
Monoisotopic Mass 174.042927438 g/mol
Topological Polar Surface Area 58.9 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 239
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

Toluene-2,6-diisocyanate is a liquid. Used in the manufacture of polyurethane foams, elastomers, and coatings; crosslinking agent for nylon 6. (EPA, 1998)