Indocyanine Green
CAS #: 3599-32-4
Product Code : E-N-A571-CU-CU
CAS #: 3599-32-4
Linear Formula: C43H47N2NaO6S2
MDL Number: MFCD00013078
EC No.: 222-751-5
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Synonyms
ICG, IC Green, Cardiogreen, Foxgreen, Fox Green, Cardio-green, Ujoviridin, 4,5-benzoindotricarbocyanine, UNII IX6J1063HV
Compound Formula: C43H47N2NaO6S2
Molecular Weight: 774.97
Appearance: Powder
Melting Point: N/A
Boiling Point: N/A
Density: N/A
Solubility in H2O: 1 mg/mL
Exact Mass: 774.277 g/mol
Monoisotopic Mass: 774.277 g/mol
Absorption: λmax775 nm
Health & Safety Information
Signal Word: N/A
Hazard Statements: N/A
Hazard Codes: N/A
Risk Codes: N/A
Safety Statements: N/A
Transport Information: N/A
Chemical Identifiers
Linear Formula: C43H47N2NaO6S2
Pubchem CID: 11967809
MDL Number: MFCD00013078
EC No.: 222-751-5
IUPAC Name: sodium; 4-[(2E)-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
Beilstein/Reaxys No.: 4115884
SMILES: CC1(C(=[N+](C2=C1C3=CC=CC=C3C=C2)CCCCS(=O)(=O)[O-])C=CC=CC=CC=C4C(C5=C(N4CCCCS(=O)(=O)[O-])C=CC6=CC=CC=C65)(C)C)C.[Na+]
InchI Identifier: InChI=1S/C43H48N2O6S2.Na/c1-42(2)38(44(28-14-16-30-52(46,47)48)36-26-24-32-18-10-12-20-34(32)40(36)42)22-8-6-5-7-9-23-39-43(3,4)41-35-21-13-11-19-33(35)25-27-37(41)45(39)29-15-17-31-53(49,50)51;/h5-13,18-27H,14-17,28-31H2,1-4H3,(H-,46,47,48,49,50,51);/q;+
InchI Key: MOFVSTNWEDAEEK-UHFFFAOYSA-M
