Chemical Compound
New Indocyanine Green
CAS Registry Number
172616-80-7
Primary Record
New Indocyanine Green
- In stock
- 6,307 g
- Purity
- 99.6 %
- CAS
- 172616-80-7
Compound Identifiers & Properties
- CAS
- 172616-80-7
- PubChem CID
- 53249358
- SMILES
- CC1(C(=[N+](C2=C1C3=CC=CC=C3C=C2)CCCCS(=O)(=O)[O-])/C=C/C4=C(/C(=C\C=C\5/C(C6=C(N5CCCCS(=O)(=O)[O-])C=CC7=CC=CC=C76)(C)C)/CCC4)Cl)C.[Na+]
- Canonical SMILES
- CC1(C)C(/C=C/C2=C(Cl)/C(=C\C=C3\N(CCCCS(=O)(=O)[O-])c4ccc5ccccc5c4C3(C)C)CCC2)=[N+](CCCCS(=O)(=O)[O-])c2ccc3ccccc3c21.[Na+]
Names & Synonyms
- New Indocyanine Green
- IR-820
- SCHEMBL29376041
- IR820
- MFCD04038859
- 172616-80-7
- New indocyanine Green, Dye content 80%
- AN-30832
- DA-64489
- FT-0778214
- 2-[2-[2-Chloro-3-[[1,3-dihydro-1,1-dimethyl-3-(4-sulfobutyl)-2H -benzo[e]indol-2-ylidene]-ethylidene]-1-cyclohexen-1-yl]-ethenyl]-1,1-dimethyl-3-(4-sulfobutyl)-1H -benzo[e ]indolium hydroxide inner salt, sodium salt
- sodium 4-[(2E)-2-[(2Z)-2-[2-chloro-3-[(E)-2-[1,1-dimethyl-3-(4-sulfonatobutyl)benzo[e]indol-3-ium-2-yl]vinyl]cyclohex-2-en-1-ylidene]ethylidene]-1,1-dimethyl-benzo[e]indol-3-yl]butane-1-sulfonate
- Sodium; 4-[(2E)-2-[(2Z)-2-[2-chloro-3-[(E)-2-[1,1-dimethyl-3-(4-sulfonatobutyl)benzo[e]indol-3-ium-2-yl]ethenyl]cyclohex-2-en-1-ylidene]ethylidene]-1,1-dimethylbenzo[e]indol-3-yl]butane-1-sulfonate
- sodium;4-[(2E)-2-[(2Z)-2-[2-chloro-3-[(E)-2-[1,1-dimethyl-3-(4-sulfonatobutyl)benzo[e]indol-3-ium-2-yl]ethenyl]cyclohex-2-en-1-ylidene]ethylidene]-1,1-dimethylbenzo[e]indol-3-yl]butane-1-sulfonate