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CAS No.: | 528-53-0 |
---|---|
Name: | Delphinidin chloride |
Article Data: | 14 |
Molecular Structure: | |
Formula: | C15H11 O7 . Cl |
Molecular Weight: | 338.701 |
Synonyms: | 1-Benzopyrylium,3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)-, chloride (9CI); Flavylium,3,3',4',5,5',7-hexahydroxy-, chloride (8CI);3,3',4',5,5',7-Hexahydroxy-2-phenylbenzopyrylium chloride;3,3',4',5,5',7-Hexahydroxyflavylium chloride; Delfinidol chloride; Delphinidin;Delphinidin chloride; Delphinidine; Delphinidol; Ephdine; IdB 1056 |
EINECS: | 208-437-0 |
Density: | g/cm3 |
Melting Point: | >349.85°C |
Boiling Point: | °Cat760mmHg |
Flash Point: | °C |
Solubility: | |
Hazard Symbols: | UN NO. |
Transport Information: | OTH |
PSA: | 134.52000 |
LogP: | -0.38150 |
Molecular Formula: C15H11ClO7
Molar mass: 338.6966 g/mol
EINECS: 208-437-0
Storage temp: -20 °C
Product categories of Delphinidin chloride (CAS NO.528-53-0): Anthocyanins;Flavonoids
Structure of Delphinidin chloride (CAS NO.528-53-0):
H-Bond Donor: 6
H-Bond Acceptor: 7
IUPAC Name of Delphinidin chloride (CAS NO.528-53-0): 2-(3,4,5-Trihydroxyphenyl)chromenylium-3,5,7-triol chloride
Canonical SMILES: C1=C(C=C(C(=C1O)O)O)C2=C(C=C3C(=CC(=CC3=[O+]2)O)O)O.[Cl-]
InChI: InChI=1S/C15H10O7.ClH/c16-7-3-9(17)8-5-12(20)15(22-13(8)4-7)6-1-10(18)14(21)11(19)2-6;/h1-5H,(H5-,16,17,18,19,20,21);1H
InChIKey: FFNDMZIBVDSQFI-UHFFFAOYSA-N
1. | ipr-rat LD50:2350 mg/kg | CHTPBA Chimica Therapeutica. 2 (1967),33. | ||
2. | ivn-rat LD50:240 mg/kg | CHTPBA Chimica Therapeutica. 2 (1967),33. | ||
3. | ipr-mus LD50:4110 mg/kg | CHTPBA Chimica Therapeutica. 2 (1967),33. | ||
4. | ivn-mus LD50:840 mg/kg | CHTPBA Chimica Therapeutica. 2 (1967),33. |
Poison by intravenous route. Moderately toxic by intraperitoneal route. When heated to decomposition it emits acrid smoke and irritating fumes.
Delphinidin chloride ,its cas register number is 528-53-0. It also can be called Delphinidin ; Flavylium 3,3',4',5,5',7-hexahydroxy-, chloride ; 1-Benzopyrylium, 3,5,7-trihydroxy-2-(3,4,5-trihydroxyphenyl)-, chloride and 3,5,7-Trihydroxy-2-(3,4,5-trihydroxyphenyl)benzopyrylium chloride .