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HITCI

CAT: 0013-GTR19332312-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19332312-02Size:50 mg
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Description
HITCI is a cationic indocarbocyanine dye commercially available for research, primarily employed as a near-infrared laser dye. Its applications extend to areas such as photodynamic therapy and bioimaging, where it is utilized in both in vitro and in vivo experimental models.
CAS Number
19764-96-6
Molecular Weight
536.49
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

1,1',3,3,3',3'-Hexamethylindotricarbocyanine iodide

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CAS Number19764-96-6
PubChem CID89218
IUPAC Name1,3,3-trimethyl-2-[7-(1,3,3-trimethylindol-1-ium-2-yl)hepta-2,4,6-trienylidene]indole iodide
Molecular FormulaC29H33IN2
Molecular Weight536.5
Topological Polar Surface Area6.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Heavy Atom Count32
Formal Charge0
Complexity756
SMILES
CC1(C2=CC=CC=C2[N+](=C1C=CC=CC=CC=C3C(C4=CC=CC=C4N3C)(C)C)C)C.[I-]
InChI
InChI=1S/C29H33N2.HI/c1-28(2)22-16-12-14-18-24(22)30(5)26(28)20-10-8-7-9-11-21-27-29(3,4)23-17-13-15-19-25(23)31(27)6;/h7-21H,1-6H3;1H/q+1;/p-1
InChIKey
JKXWXYURKUEZHV-UHFFFAOYSA-M
Chemical Structure
2D Structure
2D structure of 1,1',3,3,3',3'-Hexamethylindotricarbocyanine iodide
CAS: 19764-96-6
CID: 89218
Formula: C29H33IN2
MW: 536.5
Interactive 3D Structure
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Computed Properties
PropertyValue
Molecular Weight536.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count2
Rotatable Bond Count4
Exact Mass536.16885
Monoisotopic Mass536.16885
Topological Polar Surface Area6.3 Ų
Heavy Atom Count32
Formal Charge0
Complexity756
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count4
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

Alternative Products

CatalogName
MBS5823847HITCI

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