fluoren-1-one;iodosylbenzene

C19H13IO2 — CID 175965867

IUPACfluoren-1-one;iodosylbenzene
SMILESO=C1C=CC=C2C1=Cc1ccccc12.O=Ic1ccccc1
InChIInChI=1S/C13H8O.C6H5IO/c14-13-7-3-6-11-10-5-2-1-4-9(10)8-12(11)13;8-7-6-4-2-1-3-5-6/h1-8H;1-5H
InChIKeyCBDUDMOIYHLEPX-UHFFFAOYSA-N
MW400.22 g/mol
LogP4.78
Rot. Bonds1

About fluoren-1-one;iodosylbenzene

fluoren-1-one;iodosylbenzene (PubChem CID 175965867) has the molecular formula C19H13IO2 and a molecular weight of 400.22 g/mol. Its IUPAC name is fluoren-1-one;iodosylbenzene.

Molecular Properties

Compound Namefluoren-1-one;iodosylbenzene
PubChem CID175965867
Molecular FormulaC19H13IO2
Molecular Weight400.22 g/mol
Exact Mass400.00
IUPAC Namefluoren-1-one;iodosylbenzene
SMILESO=C1C=CC=C2C1=Cc1ccccc12.O=Ic1ccccc1
InChIInChI=1S/C13H8O.C6H5IO/c14-13-7-3-6-11-10-5-2-1-4-9(10)8-12(11)13;8-7-6-4-2-1-3-5-6/h1-8H;1-5H
InChIKeyCBDUDMOIYHLEPX-UHFFFAOYSA-N
XLogP4.78
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.22
LogP ≤ 54.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of fluoren-1-one;iodosylbenzene?
The IUPAC name of fluoren-1-one;iodosylbenzene (CID 175965867) is fluoren-1-one;iodosylbenzene.
What is the SMILES notation for fluoren-1-one;iodosylbenzene?
The canonical SMILES for fluoren-1-one;iodosylbenzene is O=C1C=CC=C2C1=Cc1ccccc12.O=Ic1ccccc1.
What is the InChIKey of fluoren-1-one;iodosylbenzene?
The InChIKey is CBDUDMOIYHLEPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8O.C6H5IO/c14-13-7-3-6-11-10-5-2-1-4-9(10)8-12(11)13;8-7-6-4-2-1-3-5-6/h1-8H;1-5H.
What are the key properties of fluoren-1-one;iodosylbenzene?
fluoren-1-one;iodosylbenzene has a molecular weight of 400.22 g/mol, XLogP of 4.78, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for fluoren-1-one;iodosylbenzene is sourced from PubChem (CID 175965867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).