HTC iodide
Basic information
- CAS
19764-96-6- Standard SMILES
CN1/C(=C\C=CC=CC=CC2=[N+](C)c3ccccc3C2(C)C)C(C)(C)c2ccccc21.[I-]- InChIKey
JKXWXYURKUEZHV-UHFFFAOYSA-M- Molecular formula
- C29H33IN2
- Average molar mass
- 536.5 g/mol
- Monoisotopic mass
- 536.16885
Overview
See other relationships...
Names & identifiers
- Preferred name
- HTC iodide
- IUPAC
- (2Z)-1,3,3-trimethyl-2-[7-(1,3,3-trimethylindol-1-ium-2-yl)hepta-2,4,6-trienylidene]indole iodide
- English name
- 1,1',3,3,3',3'-Hexamethylindotricarbocyanine iodide
- Molecular formula
- C29H33IN2
- Molecular weight
- 536.49
Names & synonyms
HTC iodide19764-96-6EINECS 243-282-2S2364HITC IODIDE3,3-trimethyl-rienyl]-iodide1 1' 3 3 3' 3'-HEXAMETHYLINDOTRICARBO- &1,1',3,3,3',3'-Hexamethylindotricarbocyanine iodide1,1',3,3,3',3'-Hexamethylindotricarbocyanine iodide1,1',3,3,3',3'-HexaMethylindotricarbocyanine iodide 97%1,1'',3,3,3'',3''-HEXAMETHYLINDOTRICARBO-CYANINE IODIDE, LASER GADE1,1',3,3,3',3'-Hexamethylindotricarbocyanineiodide,pure,laser grade
Show more names
Iodide-1,1 ', 3,3,3', 3 '- Hexamethylindole tricarbonyl anthocyanin
Database identifiers
- CAS
19764-96-6- PubChem CID
- 5484020
Properties
Computed structural properties
- Topological polar surface area
- 6.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 756
Physicochemical properties
- Melting point
- 198 °C · 198 °C (dec.)(lit.)
- form
- solid
- λmax
- 740 nm · 740 nm
- 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
- SMILES
- [I-].CN1c2ccccc2C(C)(C)\C1=C\C=C\C=C\C=C\C3=[N+](C)c4ccccc4C3(C)C
- EPA Substance Registry System
- 3 H-Indolium, · 3H-Indolium, 2-[7-(1,3-dihydro-1,3,3-trimethyl-2H-indol-2-ylidene)-1,3,5-heptatrienyl]-1,3,3-trimethyl-, iodide (19764-96-6)
- UNSPSC Code
- 12352103 · 12352103
- NACRES
- 23 · NA.23
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 261 · P261-P264-P271-P280-P302+P352-P305+P351+P338
- target organs
- Respiratory system
- Hazard Codes
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- wgk
- 3
- tsca
- TSCA listed
- hs_code
- 32049000
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 24/25-36-26-22
- Storage Class
- 11 - Combustible Solids
- target organs
- Respiratory system
- Hazard statements
- H315-H319-H335
- Hazard Classifications
- Eye Irrit. 2Skin Irrit. 2STOT SE 3
- Precautionary statements
- P261-P264-P271-P280-P302+P352-P305+P351+P338
Chemistry & industry
Applications
Description1,1',3,3,3',3'-Hexamethylindotricarbocyanine iodide is a highly potent fluorescent dye widely utilized in biomedical research and proves invaluable for cell labeling and monitoring, as well as tracking cellular processes in real-time. This remarkable dye showcases exceptional aptitude in investigating mitochondrial function and dynamics. Furthermore, it boasts an ability to detect and precisely identify specific proteins and organelles residing within cells. Its diverse applications extend to dissecting ailments like cancer, neurodegenerative disorders, and even cardiovascular diseases.
UsesSuitable as laser dye
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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