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106-49-0

106-49-0 structural image
Product Name: p-Toluidine
Formula: C7H9N
Synonyms: p-Toluidine;4-Aminotoluene;4-Aminotoluene, 4-Methylaniline;4-Methylaniline
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description P-toluidine is a colorless solid. Melting point 44 °C (111 °F). Specific gravity 1.046. Vapor heavier than air. Produces toxic oxides of nitrogen during combustion. May be absorbed through the skin. Used in dyes, and in organic chemical manufacturing.
Color/Form Lustrous plates or leaflets
Odor Aromatic, wine-like odor
Taste Burning taste
Boiling Point 393 °F at 760 mmHg (USCG, 1999)
Melting Point 112.1 °F (USCG, 1999)
Flash Point 188 °F (USCG, 1999)
Solubility 0.7 % (NIOSH, 2023)
Density 1 at 68 °F (USCG, 1999)
Vapor Density 3.90 (Air = 1)
Vapor Pressure 1 mmHg at 108 °F (NIOSH, 2023)
LogP log Kow = 1.39
Henry's Law Constant Henry's Law constant = 2.02X10-6 atm-cu m/mol at 25 °C
Autoignition Temperature 899 °F (USCG, 1999)
Decomposition When heated to decomposition it emits highly toxic fumes of /nitroxides/.
Heat of Vaporization 44.3 kJ/mol at 200.4 °C
Ionization Potential 7.50 eV
Ionization Efficiency Positive
Odor Threshold Odor Threshold Low: 0.02 [mmHg] Odor Threshold High: 3.2 [mmHg] Odor threshold from AIHA
Refractive Index Index of refraction: 1.5534 at 45 °C/D
Dissociation Constants pKa = 5.10 at 25 °C (conjugate acid)
Kovats Retention Index 1042.1 1068 1092 1092 1055.3 1056.5 1037
Other Experimental Properties Heat of fusion: 18.9 kJ/mol at 43.6 °C
Chemical Classes Nitrogen Compounds -> Amines, Aromatic

SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Skull and Crossbones
Acute Toxicity
GHS06

Health Hazard
GHS08

Environment
GHS09
GHS Hazard Statements H317:Sensitisation, Skin
H319:Serious eye damage/eye irritation
H351:Carcinogenicity
H410: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+P310:IF SWALLOWED: 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 107.15 g/mol
XLogP3 1.4
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 0
Exact Mass 107.073499291 g/mol
Monoisotopic Mass 107.073499291 g/mol
Topological Polar Surface Area 26 Ų
Heavy Atom Count 8
Formal Charge 0
Complexity 62.8
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

P-toluidine is a colorless solid. Melting point 44 °C (111 °F). Specific gravity 1.046. Vapor heavier than air. Produces toxic oxides of nitrogen during combustion. May be absorbed through the skin. Used in dyes, and in organic chemical manufacturing.

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