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95-53-4

95-53-4 structural image
Product Name: o-Toluidine
Formula: C7H9N
Synonyms: 2-Aminotoluene;2-Aminotoluene, 2-Methylaniline;2-Methylaniline;o-Toluidine
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description O-toluidine appears as a clear colorless or light yellow liquid. May become reddish brown on exposure to air and light. Flash point 185 °F. Has about the same density as water and is very slightly soluble in water. Vapors are heavier than air. Confirmed carcinogen.
Boiling Point 392 to 396 °F at 760 mmHg (NTP, 1992)
Melting Point 2.7 °F (NTP, 1992)
Flash Point 185 °F (NTP, 1992)
Solubility 5 to 10 mg/mL at 59 °F (NTP, 1992)
Density 0.998 at 68 °F (USCG, 1999) - Less dense than water; will float
Vapor Density 3.69 (NTP, 1992) - Heavier than air; will sink (Relative to Air)
Vapor Pressure 0.1 mmHg at 68 °F ; 0.3 mmHg at 86 °F (NTP, 1992)
LogP 1.32
Autoignition Temperature 900 °F (USCG, 1999)
Ionization Potential 7.44 eV
Ionization Efficiency Positive
Odor Threshold Odor Threshold Low: 0.02 [mmHg] Odor Threshold High: 6.6 [mmHg] Odor threshold from AIHA
Kovats Retention Index 1032.7 1040.5 1068 1068 1053 1053.9 1053.9 1037
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 H319:Serious eye damage/eye irritation
H350:Carcinogenicity
H410:Hazardous to the aquatic environment, long-term hazard
Precautionary Statement Codes P202:Do not handle until all safety precautions have been read and understood.
P261:Avoid breathing dust/fume/gas/mist/vapours/spray.
P273:Avoid release to the environment.
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 1.3
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 70.8
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

O-toluidine appears as a clear colorless or light yellow liquid. May become reddish brown on exposure to air and light. Flash point 185 °F. Has about the same density as water and is very slightly soluble in water. Vapors are heavier than air. Confirmed carcinogen.

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