Indocyanine Green
sodium 4-[(2Z)-2-[(2E,4E,6E)-7-[1,1-dimethyl-3-(4-sulfonatobutyl)benzo[e]indol-3-ium-2-yl]hepta-2,4,6-trienylidene]-1,1-dimethylbenzo[e]indol-3-yl]butane-1-sulfonate
Also Known As: indocyanine green|Cardiogreen|Wofaverdin|Cardio-Green|Ujoviridin|Fox Green|IC-Green|Ujoveridin|Vofaverdin|Vophaverdin|Foxgreen|Cardio Green|Spy agent green|Ujovirdin|Green, Indocyanine|verde indocianina|HWD Indocyanine Green|Sindocyanine green|vert d'indocyanine|IC Green|SPY Elite Kit|SPY Lymphatics Kit|Verde de indocianina|SPY-MIS Kit|SPY-PHI Kit|IC-Green (TN)|PINPOINT Lymphatics Kit|Indocyanine green [USP:JAN]|SPY AGENT GREEN KIT|Indocyanine Green and Water|4,5-Benzoindotricarbocyanine|IR 125|Sucrose, crude (cane sugar)
| Molecular Formula | C43H47N2NaO6S2 |
|---|---|
| Molecular Weight | 774.27734 g/mol |
| LogP | 5.3743 |
| Topological Polar Surface Area | 120.65 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 14 |
| Exact Mass | 774.27734 |
| Monoisotopic Mass | 774.27734 |
| Heavy Atoms | 54 |
| Complexity | 2426.4934 |
Chemical Identifiers
| CAS Number | 1814902-08-3 |
|---|---|
| SMILES | CC1(C(=[N+](C2=C1C3=CC=CC=C3C=C2)CCCCS(=O)(=O)[O-])/C=C/C=C/C=C/C=C\4/C(C5=C(N4CCCCS(=O)(=O)[O-])C=CC6=CC=CC=C65)(C)C)C.[Na+] |
Product Overview
Indocyanine Green (CAS 1814902-08-3), with molecular formula C43H47N2NaO6S2 and molecular weight 774.27734 g/mol. IUPAC: sodium 4-[(2Z)-2-[(2E,4E,6E)-7-[1,1-dimethyl-3-(4-sulfonatobutyl)benzo[e]indol-3-ium-2-yl]hepta-2,4,6-trienylidene]-1,1-dimethylbenzo[e]indol-3-yl]butane-1-sulfonate.