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87-62-7

87-62-7 structural image
Product Name: 2,6-Dimethylaniline
Formula: C8H11N
Synonyms: 2,6-Dimethylaniline;2,6-Xylidine;2-Amino-m-xylene;2-Amino-1,3-dimethylbenzene;vic.-m-Xylidine
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description 2,6-xylidine appears as a liquid. Toxic by ingestion, inhalation and skin absorption. Slightly soluble in water. Used in pharmaceuticals, as dye intermediates and organic syntheses.
Color/Form Yellow liquid
Odor Characteristic odor
Boiling Point 417 °F at 739 mmHg (NTP, 1992)
Melting Point 47.1 °F (NTP, 1992)
Flash Point 196 °F (NTP, 1992)
Solubility less than 1 mg/mL at 75 °F (NTP, 1992)
Density 0.984 (USCG, 1999) - Less dense than water; will float
Vapor Density 4.17 (NTP, 1992) - Heavier than air; will sink (Relative to Air)
Vapor Pressure 1 mmHg at 111.2 °F ; 5 mmHg at 162.7 °F; 100 mmHg at 295 °F (NTP, 1992)
LogP log Kow = 1.84
Stability/Shelf Life Stable under recommended storage conditions.
Autoignition Temperature 761 °F (NTP, 1992)
Decomposition When heated to decomposition it emits toxic fumes of /nitrogen oxides/.
Viscosity 1.7 mPa.s (dynamic) at 50 °C
Heat of Vaporization Enthalpy of vaporization: 59.2 kJ/mol at 286-326 K
Odor Threshold Odor threshold in air= 1.00X10+12 molecules/cc /Xylidines/
Refractive Index Index of refraction: 1.5610 at 20 °C/D
Dissociation Constants pKa = 3.95 at 25 °C
Kovats Retention Index 1136.2 1135.52 1136.26 1136.34 1137.15 1137.93 1143.41 1179 1140.7 1149 1131 1134 1143 1143 1146 1157 1173 1130
Other Experimental Properties Forms more or less sol salts with the strong mineral acids /Xylidine/

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07

Health Hazard
GHS08

Environment
GHS09
GHS Hazard Statements H315:Skin corrosion/irritation
H335:Specific target organ toxicity, single exposure;Respiratory tract irritation
H351:Carcinogenicity
H411:Hazardous to the aquatic environment, long-term hazard
Precautionary Statement Codes P273:Avoid release to the environment.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P301+P312:IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell.
P308+P313:IF exposed or concerned: Get medical advice/attention.

COMPUTED DESCRIPTORS

Molecular Weight 121.18 g/mol
XLogP3 1.8
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 0
Exact Mass 121.089149355 g/mol
Monoisotopic Mass 121.089149355 g/mol
Topological Polar Surface Area 26 Ų
Heavy Atom Count 9
Formal Charge 0
Complexity 80.6
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

2,6-xylidine appears as a liquid. Toxic by ingestion, inhalation and skin absorption. Slightly soluble in water. Used in pharmaceuticals, as dye intermediates and organic syntheses.

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