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1843-05-6

1843-05-6 structural image
Product Name: Octabenzone
Formula: C21H26O3
Synonyms: [2-Hydroxy-4-(octyloxy)phenyl]phenylmethanone;2-Benzoyl-5-octyloxyphenol;4-(Octyloxy)-2-hydroxybenzophenone
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Dry Powder; Liquid; NKRA; Other Solid; Pellets or Large Crystals
Color/Form Crystals
Boiling Point >300 °C decomposes
Melting Point 45-46 °C
Solubility In water, <0.001 mg/L at 20 °C, pH 6 /OECD Guideline 105 (Water Solubility)/
Density 1160 kg/cu m at 20 °C
Vapor Pressure 3.38X10-8 mm Hg at 20 °C (measured by transpiration method)
Stability/Shelf Life Stable under recommended storage conditions.
Decomposition Hazardous decomposition products formed under fire conditions. - Carbon oxides
Heat of Vaporization Enthalpy of vaporization: 102.1 kJ/mol
Dissociation Constants pKa = 10.16 at 25 °C (Estimated with SPARC, OH-group)
Chemical Classes Other Uses -> Sunscreens

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H317:Sensitisation, Skin
Precautionary Statement Codes P280:Wear protective gloves/protective clothing/eye protection/face protection.

COMPUTED DESCRIPTORS

Molecular Weight 326.4 g/mol
XLogP3 6.8
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 10
Exact Mass 326.18819469 g/mol
Monoisotopic Mass 326.18819469 g/mol
Topological Polar Surface Area 46.5 Ų
Heavy Atom Count 24
Formal Charge 0
Complexity 349
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

Octabenzone is a member of benzophenones.

RELATED SUPPLIERS

DHANVI EXIM SERVICES

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product:1843-05-6 (2-hydroxy-4-(octyloxy)phenyl)(phenyl)methanone (BP12 octabenzone)
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