DTTCI

Catalog Number

ACM3071703-3

CAS

3071-70-3

Structure

Synonyms

3,3'-Diethylthiatricarbocyanineiodide

IUPAC Name

(2Z)-3-ethyl-2-[(2E,4E,6E)-7-(3-ethyl-1,3-benzothiazol-3-ium-2-yl)hepta-2,4,6-trienylidene]-1,3-benzothiazole;iodide

Molecular Weight

544.52

Molecular Formula

C25H25N2S2I

Canonical SMILES

CCN\1C2=CC=CC=C2S/C1=C\C=C\C=C\C=C\C3=[N+](C4=CC=CC=C4S3)CC.[I-]

InChI

InChI=1S/C25H25N2S2.HI/c1-3-26-20-14-10-12-16-22(20)28-24(26)18-8-6-5-7-9-19-25-27(4-2)21-15-11-13-17-23(21)29-25;/h5-19H,3-4H2,1-2H3;1H/q+1;/p-1

InChI Key

OYVFJKVYVDYPFV-UHFFFAOYSA-M

Melting Point

211 °C

Purity

98%+

Appearance

Green powder

Storage

Stored at -20 °C

Emission Maximum

800 nm

Excitation Maximum

763 nm

• Catalog Number: ACM3071703-3
• CAS: 3071-70-3
• Synonyms: 3,3'-Diethylthiatricarbocyanineiodide
• IUPAC Name: (2Z)-3-ethyl-2-[(2E,4E,6E)-7-(3-ethyl-1,3-benzothiazol-3-ium-2-yl)hepta-2,4,6-trienylidene]-1,3-benzothiazole;iodide
• Molecular Weight: 544.52
• Molecular Formula: C25H25N2S2I
• Canonical SMILES: CCN\1C2=CC=CC=C2S/C1=C\C=C\C=C\C=C\C3=[N+](C4=CC=CC=C4S3)CC.[I-]
• InChI: InChI=1S/C25H25N2S2.HI/c1-3-26-20-14-10-12-16-22(20)28-24(26)18-8-6-5-7-9-19-25-27(4-2)21-15-11-13-17-23(21)29-25;/h5-19H,3-4H2,1-2H3;1H/q+1;/p-1
• InChI Key: OYVFJKVYVDYPFV-UHFFFAOYSA-M
• Melting Point: 211 °C
• Purity: 98%+
• Appearance: Green powder
• Storage: Stored at -20 °C
• Emission Maximum: 800 nm
• Excitation Maximum: 763 nm