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1948-33-0

1948-33-0 structural image
Product Name: tert-Butylhydroquinone
Formula: C10H14O2
Synonyms: 2-(1,1-Dimethylethyl)-1,4-benzenediol;2-tert.-Butyl-1,4-dihydroxybenzene;NSC 4972;tert-Butylhydroquinone
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Tert-butylhydroquinone appears as white to light tan crystalline powder or a fine beige powder. Very slight aromatic odor. (NTP, 1992)
Color/Form White to light tan crystalline powder or a fine beige powder
Odor Very slight aromatic odor
Boiling Point 563 °F at 760 mmHg (NTP, 1992)
Melting Point 261 to 264 °F (NTP, 1992)
Flash Point 340 °F (NTP, 1992)
Solubility less than 1 mg/mL at 66 °F (NTP, 1992)
Density 1.05 (NTP, 1992) - Denser than water; will sink
Vapor Density 5.73 (NTP, 1992) - Heavier than air; will sink (Relative to Air)
Vapor Pressure less than 1 mmHg at 68 °F (NTP, 1992)
Stability/Shelf Life Stable under recommended storage conditions.
Decomposition When heated to decomposition it emits acrid smoke and irritating fumes.
pH pH = 4.56 at 25 °C of a 1% solution of 2-tert-butylhydroquinone
Dissociation Constants pKa = 10.7 at 22 °C
Kovats Retention Index 1566
Chemical Classes Other Classes -> Phenols

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07

Environment
GHS09
GHS Hazard Statements H315:Skin corrosion/irritation
H317:Sensitisation, Skin
H319:Serious eye damage/eye irritation
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.
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 166.22 g/mol
XLogP3 2.8
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 1
Exact Mass 166.099379685 g/mol
Monoisotopic Mass 166.099379685 g/mol
Topological Polar Surface Area 40.5 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 148
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

Tert-butylhydroquinone appears as white to light tan crystalline powder or a fine beige powder. Very slight aromatic odor. (NTP, 1992)

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