DiOC2 (3) membrane potential fluorescent probe

CAT: 1489-D3860-01Size: 20 mgDry Ice: NoHazardous: No

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CAT#:1489-D3860-01Size:20 mg

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CAS Number

905-96-4

Chemical Information

3,3'-Diethyloxacarbocyanine iodide

CAS Number	905-96-4
PubChem CID	6538326
IUPAC Name	(2Z)-3-ethyl-2-[(E)-3-(3-ethyl-1,3-benzoxazol-3-ium-2-yl)prop-2-enylidene]-1,3-benzoxazole iodide
Molecular Formula	C21H21IN2O2
Molecular Weight	460.3
Topological Polar Surface Area	29.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Heavy Atom Count	26
Formal Charge	0
Complexity	474

SMILES

CCN\1C2=CC=CC=C2O/C1=C\C=C\C3=[N+](C4=CC=CC=C4O3)CC.[I-]

InChI

InChI=1S/C21H21N2O2.HI/c1-3-22-16-10-5-7-12-18(16)24-20(22)14-9-15-21-23(4-2)17-11-6-8-13-19(17)25-21;/h5-15H,3-4H2,1-2H3;1H/q+1;/p-1

InChIKey

FIZZUEJIOKEFFZ-UHFFFAOYSA-M

Chemical Structure

2D Structure

CAS: 905-96-4

CID: 6538326

Formula: C21H21IN2O2

MW: 460.3

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	460.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	4
Exact Mass	460.06478
Monoisotopic Mass	460.06478
Topological Polar Surface Area	29.5 Å²
Heavy Atom Count	26
Formal Charge	0
Complexity	474
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	2
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	2
Compound Is Canonicalized	Yes

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