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Nile Blue A perchlorate

CAT: 0013-GTR19304804-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19304804-01Size:10 mg
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Description
Nile Blue A perchlorate is a versatile laser dye suitable for both pulsed and CW laser systems. It is employed in fluorescence imaging and photodynamic therapy research, with applications in both in vitro staining and in vivo studies for biological tracing.
CAS Number
53340-16-2
Molecular Weight
417.84
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Nile Blue perchlorate

Nile blue perchlorate is an organic perchlorate salt. It has a role as a fluorochrome. It contains a nile blue(1+).

CAS Number53340-16-2
PubChem CID40736
IUPAC Name(5-aminobenzo[a]phenoxazin-9-ylidene)-diethylazanium perchlorate
Molecular FormulaC20H20ClN3O5
Molecular Weight417.8
Topological Polar Surface Area125
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count2
Heavy Atom Count29
Formal Charge0
Complexity721
SMILES
CC[N+](=C1C=CC2=NC3=C(C=C(C4=CC=CC=C43)N)OC2=C1)CC.[O-]Cl(=O)(=O)=O
InChI
InChI=1S/C20H19N3O.ClHO4/c1-3-23(4-2)13-9-10-17-18(11-13)24-19-12-16(21)14-7-5-6-8-15(14)20(19)22-17;2-1(3,4)5/h5-12,21H,3-4H2,1-2H3;(H,2,3,4,5)
InChIKey
OUAWJLNOTQAOHL-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Nile Blue perchlorate
CAS: 53340-16-2
CID: 40736
Formula: C20H20ClN3O5
MW: 417.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight417.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count2
Exact Mass417.1091484
Monoisotopic Mass417.1091484
Topological Polar Surface Area125 Ų
Heavy Atom Count29
Formal Charge0
Complexity721
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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