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591-27-5

591-27-5 structural image
Product Name: 3-Aminophenol
Formula: C6H7NO
Synonyms: m-Aminophenol;3-Aminophenol;3-Hydroxyaniline;m-Aminophenol
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description M-aminophenol appears as white crystals or off-white flakes. (NTP, 1992)
Color/Form White prisms from toluene or water
Boiling Point 327 °F at 11 mmHg (NTP, 1992)
Melting Point 253 to 259 °F (NTP, 1992)
Solubility 1 to 10 mg/mL at 75 °F (NTP, 1992)
Density 1.195 g/cu cm
Vapor Pressure 0.00955 [mmHg]
LogP log Kow = 0.21 at pH 5.6
Decomposition When heated to decomposition it emits toxic fumes of /nitrogen oxides/.
Ionization Efficiency Positive
Dissociation Constants pK1 = 4.37 at 20 °C; pK2 = 9.815 at 20 °C (conjugate acid)
Kovats Retention Index 1335 1335 1335
Other Experimental Properties Heat of formation = -194.1 kJ/mol
Chemical Classes Nitrogen Compounds -> Amino Phenols

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07

Environment
GHS09
GHS Hazard Statements H319:Serious eye damage/eye irritation
H411:Hazardous to the aquatic environment, long-term hazard
Precautionary Statement Codes P261:Avoid breathing dust/fume/gas/mist/vapours/spray.
P264:Wash hands thoroughly after handling.
P264:Wash skin thouroughly after handling.
P273:Avoid release to the environment.
P301+P312:IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell.
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 109.13 g/mol
XLogP3 0.2
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 0
Exact Mass 109.052763847 g/mol
Monoisotopic Mass 109.052763847 g/mol
Topological Polar Surface Area 46.2 Ų
Heavy Atom Count 8
Formal Charge 0
Complexity 74.9
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

M-aminophenol appears as white crystals or off-white flakes. (NTP, 1992)

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