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Cyanine3.5 dimethyl

CAT: 0013-GTR19340377-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19340377-01Size:10 mg
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Description
Cyanine3.5 dimethyl is a non-sulfonated cyanine dye that is well-soluble in organic solvents and exhibits bright fluorescence in the yellow-orange spectrum range. This dye can be utilized as a non-reactive fluorophore for control experiments, calibration, and various other technical applications.
CAS Number
42849-61-6
Molecular Weight
493.082
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

1,1,3-Trimethyl-2-[3-(1,1,3-trimethylbenzo[e]indol-3-ium-2-yl)prop-2-enylidene]benzo[e]indole chloride
CAS Number42849-61-6
PubChem CID177823137
IUPAC Name1,1,3-trimethyl-2-[3-(1,1,3-trimethylbenzo[e]indol-3-ium-2-yl)prop-2-enylidene]benzo[e]indole chloride
Molecular FormulaC33H33ClN2
Molecular Weight493.1
Topological Polar Surface Area6.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count36
Formal Charge0
Complexity848
SMILES
CC1(C(=[N+](C2=C1C3=CC=CC=C3C=C2)C)C=CC=C4C(C5=C(N4C)C=CC6=CC=CC=C65)(C)C)C.[Cl-]
InChI
InChI=1S/C33H33N2.ClH/c1-32(2)28(34(5)26-20-18-22-12-7-9-14-24(22)30(26)32)16-11-17-29-33(3,4)31-25-15-10-8-13-23(25)19-21-27(31)35(29)6;/h7-21H,1-6H3;1H/q+1;/p-1
InChIKey
LGRHNNUMEPGXBG-UHFFFAOYSA-M
Chemical Structure
2D Structure
2D structure of 1,1,3-Trimethyl-2-[3-(1,1,3-trimethylbenzo[e]indol-3-ium-2-yl)prop-2-enylidene]benzo[e]indole chloride
CAS: 42849-61-6
CID: 177823137
Formula: C33H33ClN2
MW: 493.1
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight493.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass492.2332268
Monoisotopic Mass492.2332268
Topological Polar Surface Area6.3 Ų
Heavy Atom Count36
Formal Charge0
Complexity848
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count2
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes