Cyanidin Chloride

CAT: 1299-RM-C015903-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-C015903-01Size:10 mg

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CAS Number

528-58-5

Synonyms

3,3',4',5,7-Pentahydroxyflavylium chloride; Cyanidol chloride

Molecular Formula

C15H11O6 Cl

Molecular Weight

287.25 35.46

Target Alternative Name

Cyanidin

Product Name Synonym

3,3',4',5,7-Pentahydroxyflavylium chloride; Cyanidol chloride

Chemical Information

Cyanidin Chloride

CAS Number	528-58-5
PubChem CID	68247
IUPAC Name	2-(3,4-dihydroxyphenyl)chromenylium-3,5,7-triol chloride
Molecular Formula	C15H11ClO6
Molecular Weight	322.69
Topological Polar Surface Area	102
Hydrogen Bond Donor Count	5
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	1
Heavy Atom Count	22
Formal Charge	0
Complexity	364

SMILES

C1=CC(=C(C=C1C2=[O+]C3=CC(=CC(=C3C=C2O)O)O)O)O.[Cl-]

InChI

InChI=1S/C15H10O6.ClH/c16-8-4-11(18)9-6-13(20)15(21-14(9)5-8)7-1-2-10(17)12(19)3-7;/h1-6H,(H4-,16,17,18,19,20);1H

InChIKey

COAWNPJQKJEHPG-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 528-58-5

CID: 68247

Formula: C15H11ClO6

MW: 322.69

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	322.69
Hydrogen Bond Donor Count	5
Hydrogen Bond Acceptor Count	6
Rotatable Bond Count	1
Exact Mass	322.0244158
Monoisotopic Mass	322.0244158
Topological Polar Surface Area	102 Å²
Heavy Atom Count	22
Formal Charge	0
Complexity	364
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

Catalog	Name
RM-C015908-01	Cyanidin 3-O-Glucoside Chloride (Kuromanin Chloride)
RM-D191900-01	Desmosine Chloride
RG-E140582-01	Tetrapropylammonium chloride
RG-A263029-01	Nicotinoyl Chloride
RG-A262321-01	α-Chlorobenzeneacetyl Chloride
RG-P022579-01	Diethylcarbamic Chloride
RG-A030501-01	Acetyl Chloride
RM-P223000-01	Pralidoxime Chloride
RM-A030800-01	Acetylcholine Chloride
RM-D171200-01	Dequalinium Chloride

Catalog	Name
FC31216	Cyanidin chloride
HY-N0499-01	Cyanidin (Chloride)
A12201-1	Cyanidin chloride 1mg
HY-N0499R-01	Cyanidin (Chloride) (Standard)
A12201-100	Cyanidin chloride 100mg
371329	Cyanidin chloride discontinued