Fluorescein | SBID = 1452 | Compound | Custom Molecule

Struc Structure

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Molecular Properties

Interactions: 26
PubChem TPSA/Å2:
Ertl TPSA/Å2:
Hydrophilicity (PubChem XLogP):
Hydrophilicity (Cheng XLogP3):
Charge: -2.0
Number of H-Bond Donors: 0.0
Number of H-Bond Acceptors: 5.0
Number of Stereogenic Bonds (E/Z):
Number of Stereogenic Atoms (R/S):
3D Volume/Å3:
Sum Formula: C20H10O5--
M / g/mol: 330.2904
Complexity:
Number of Conformers:

Identifiers

  • Tags: aromatic, anion, dye, charged, drug
  • Name: Fluorescein
  • Preferred Abbreviation: Fluorescein
  • IUPAC Name:
  • CAS:
  • CID: -539
  • InChiKey: YKGGGCXBWXHKIZ-UHFFFAOYSA-L
  • InChi: InChI=1S/C20H12O5/c21-11-5-7-15-17(9-11)25-18-10-12(22)6-8-16(18)19(15)13-3-1-2-4-14(13)20(23)24/h1-10,21H,(H,23,24)/p-2
  • CanoSmiles: [O-]c1ccc2c(c1)oc1-c(c2c2ccccc2C(=O)[O-])ccc(=O)c1
  • IsoSmiles: [O-]C1=CC=C(C(C2=CC=CC=C2C([O-])=O)=C3C=C4)C(OC3=CC4=O)=C1