Indocyanine green

C43H47N2NaO6S2CAS 3599-32-4774.97 g/mol

NSO−OON+SO−OONa+
AlkeneSulfonic acidTertiary amine

Properties

Molecular formula
C43H47N2NaO6S2
Molar mass
774.97 g/mol
Exact mass
774.2773 Da
logP
8.33Crippen estimate
Polar surface area
117.8 Ų
H-bond donors / acceptors
1 / 6
Rotatable bonds
14

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

Identifiers

CAS number
3599-32-4
SMILES
CC1(C)C(C=CC=CC=CC=C2N(CCCCS([O-])(=O)=O)c3ccc4ccccc4c3C2(C)C)=[N+](CCCCS([O-])(=O)=O)c2ccc3ccccc3c12.[Na+]
InChI

The InChI we hold for this record describes the parent acid and the metal separately rather than the salt above, so it is not shown here.

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

16 names · show all
  • 1H-Benz[e]indolium, 2-[7-[1,3-dihydro-1,1-dimethyl-3-(4-sulfobutyl)-2H-benz[e]indol-2-ylidene]-1,3,5-heptatrien-1-yl]-1,1-dimethyl-3-(4-sulfobutyl)-, inner salt, sodium salt (1:1)
  • 1H-Benz[e]indolium, 2-[7-[1,1-dimethyl-3-(4-sulfobutyl)benz[e]indolin-2-ylidene]-1,3,5-heptatrienyl]-1,1-dimethyl-3-(4-sulfobutyl)-, hydroxide, inner salt, sodium salt
  • 1H-Benz[e]indolium, 2-[7-[1,3-dihydro-1,1-dimethyl-3-(4-sulfobutyl)-2H-benz[e]indol-2-ylidene]-1,3,5-heptatrienyl]-1,1-dimethyl-3-(4-sulfobutyl)-, hydroxide, inner salt, sodium salt
  • 1H-Benz[e]indolium, 2-[7-[1,3-dihydro-1,1-dimethyl-3-(4-sulfobutyl)-2H-benz[e]indol-2-ylidene]-1,3,5-heptatrienyl]-1,1-dimethyl-3-(4-sulfobutyl)-, inner salt, sodium salt
  • ICG
  • Cardio green
  • Wofaverdin
  • Indocyanin green
  • Ujoviridin
  • HWD indocyanine green
  • 4,5-Benzoindotricarbocyanine
  • IR 125
  • NK 2611
  • NK 2612
  • Opthagreen
  • SO 270

Work with Indocyanine green

Similar compounds

Tanimoto similarity of circular fingerprints over the whole catalogue.

Elsewhere