2-[(Z)-(fluoren-9-ylidenehydrazinylidene)methyl]-4,6-diiodophenol

C20H12I2N2O — CID 136678691

IUPAC2-[(Z)-(fluoren-9-ylidenehydrazinylidene)methyl]-4,6-diiodophenol
SMILESOc1c(I)cc(I)cc1/C=N\N=C1c2ccccc2-c2ccccc21
InChIInChI=1S/C20H12I2N2O/c21-13-9-12(20(25)18(22)10-13)11-23-24-19-16-7-3-1-5-14(16)15-6-2-4-8-17(15)19/h1-11,25H/b23-11-
InChIKeyAEUKQEGKAMVPNJ-KSEXSDGBSA-N
MW550.14 g/mol
LogP5.45
Rot. Bonds2

About 2-[(Z)-(fluoren-9-ylidenehydrazinylidene)methyl]-4,6-diiodophenol

2-[(Z)-(fluoren-9-ylidenehydrazinylidene)methyl]-4,6-diiodophenol (PubChem CID 136678691) has the molecular formula C20H12I2N2O and a molecular weight of 550.14 g/mol. Its IUPAC name is 2-[(Z)-(fluoren-9-ylidenehydrazinylidene)methyl]-4,6-diiodophenol.

Molecular Properties

Compound Name2-[(Z)-(fluoren-9-ylidenehydrazinylidene)methyl]-4,6-diiodophenol
PubChem CID136678691
Molecular FormulaC20H12I2N2O
Molecular Weight550.14 g/mol
Exact Mass549.90
IUPAC Name2-[(Z)-(fluoren-9-ylidenehydrazinylidene)methyl]-4,6-diiodophenol
SMILESOc1c(I)cc(I)cc1/C=N\N=C1c2ccccc2-c2ccccc21
InChIInChI=1S/C20H12I2N2O/c21-13-9-12(20(25)18(22)10-13)11-23-24-19-16-7-3-1-5-14(16)15-6-2-4-8-17(15)19/h1-11,25H/b23-11-
InChIKeyAEUKQEGKAMVPNJ-KSEXSDGBSA-N
XLogP5.45
TPSA44.95 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500550.14
LogP ≤ 55.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_A(479)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[(Z)-(fluoren-9-ylidenehydrazinylidene)methyl]-4,6-diiodophenol?
The IUPAC name of 2-[(Z)-(fluoren-9-ylidenehydrazinylidene)methyl]-4,6-diiodophenol (CID 136678691) is 2-[(Z)-(fluoren-9-ylidenehydrazinylidene)methyl]-4,6-diiodophenol.
What is the SMILES notation for 2-[(Z)-(fluoren-9-ylidenehydrazinylidene)methyl]-4,6-diiodophenol?
The canonical SMILES for 2-[(Z)-(fluoren-9-ylidenehydrazinylidene)methyl]-4,6-diiodophenol is Oc1c(I)cc(I)cc1/C=N\N=C1c2ccccc2-c2ccccc21.
What is the InChIKey of 2-[(Z)-(fluoren-9-ylidenehydrazinylidene)methyl]-4,6-diiodophenol?
The InChIKey is AEUKQEGKAMVPNJ-KSEXSDGBSA-N. The full InChI is InChI=1S/C20H12I2N2O/c21-13-9-12(20(25)18(22)10-13)11-23-24-19-16-7-3-1-5-14(16)15-6-2-4-8-17(15)19/h1-11,25H/b23-11-.
What are the key properties of 2-[(Z)-(fluoren-9-ylidenehydrazinylidene)methyl]-4,6-diiodophenol?
2-[(Z)-(fluoren-9-ylidenehydrazinylidene)methyl]-4,6-diiodophenol has a molecular weight of 550.14 g/mol, XLogP of 5.45, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(Z)-(fluoren-9-ylidenehydrazinylidene)methyl]-4,6-diiodophenol is sourced from PubChem (CID 136678691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).