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528-53-0

528-53-0 structural image
Product Name: DELPHINIDIN CHLORIDE
Formula: C15H11ClO7
Synonyms: 3,3′,4′,5,5′,7-Hexahydroxyflavylium chloride;3,5,7-Trihydroxy-2-(3,4,5-trihydroxyphenyl)-1-benzopyrylium chloride
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Transparent colorless oily liquid. Practically tasteless and odorless, even when warmed. (NTP, 1992)
Color/Form Colorless, oily liquid
Odor Practically odorless even when warmed
Taste Practically tasteless even when warmed
Boiling Point Very high (USCG, 1999)
Melting Point 0 °F (NIOSH, 2023)
Flash Point 380 °F (USCG, 1999)
Solubility Insoluble (NIOSH, 2023)
Density 0.822 at 68 °F (USCG, 1999) - Less dense than water; will float
Vapor Pressure less than 0.5 mmHg (NIOSH, 2023)
Stability/Shelf Life Stable under recommended storage conditions.
Decomposition When heated to decomposition it emits acrid smoke and fumes.
Viscosity Kinematic viscosity not less than 38.1 centistokes at 37.8 °C
Surface Tension At 25 °C slightly below 35 dynes/cm
Collision Cross Section 171.35 Ų [M]+ [CCS Type: DT, Method: stepped-field]
Other Experimental Properties Develops not more than a faint odor of petroleum when heated; free or nearly free from fluorescence
Chemical Classes UVCB

COMPUTED DESCRIPTORS

Molecular Weight 338.69 g/mol
Hydrogen Bond Donor Count 6
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 1
Exact Mass 338.0193304 g/mol
Monoisotopic Mass 338.0193304 g/mol
Topological Polar Surface Area 122 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 380
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 2
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Transparent colorless oily liquid. Practically tasteless and odorless, even when warmed. (NTP, 1992)