DiOC2(3)

Catalog Number

ACM905964-3

CAS

905-96-4

Structure

Synonyms

3,3'-Diethyloxacarbocyanine,iodide

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 Weight

460.31

Molecular Formula

C21H21IN2O2

Canonical 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

InChI Key

FIZZUEJIOKEFFZ-UHFFFAOYSA-M

Melting Point

278 °C

Purity

98%

Appearance

Orange solid

Emission Maximum

497 nm

Excitation Maximum

482 nm

Packaging

1 mg/5 mg

• Catalog Number: ACM905964-3
• CAS: 905-96-4
• Synonyms: 3,3'-Diethyloxacarbocyanine,iodide
• 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 Weight: 460.31
• Molecular Formula: C21H21IN2O2
• Canonical 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
• InChI Key: FIZZUEJIOKEFFZ-UHFFFAOYSA-M
• Melting Point: 278 °C
• Purity: 98%
• Appearance: Orange solid
• Emission Maximum: 497 nm
• Excitation Maximum: 482 nm
• Packaging: 1 mg/5 mg