9H-fluoren-1-yloxy-hydroxy-oxophosphanium

C13H10O3P+ — CID 172827585

IUPAC9H-fluoren-1-yloxy-hydroxy-oxophosphanium
SMILESO=[P+](O)Oc1cccc2c1Cc1ccccc1-2
InChIInChI=1S/C13H9O3P/c14-17(15)16-13-7-3-6-11-10-5-2-1-4-9(10)8-12(11)13/h1-7H,8H2/p+1
InChIKeyAVWKHAIOAQULDL-UHFFFAOYSA-O
MW245.19 g/mol
LogP3.29
Rot. Bonds2

About 9H-fluoren-1-yloxy-hydroxy-oxophosphanium

9H-fluoren-1-yloxy-hydroxy-oxophosphanium (PubChem CID 172827585) has the molecular formula C13H10O3P+ and a molecular weight of 245.19 g/mol. Its IUPAC name is 9H-fluoren-1-yloxy-hydroxy-oxophosphanium.

Molecular Properties

Compound Name9H-fluoren-1-yloxy-hydroxy-oxophosphanium
PubChem CID172827585
Molecular FormulaC13H10O3P+
Molecular Weight245.19 g/mol
Exact Mass245.04
IUPAC Name9H-fluoren-1-yloxy-hydroxy-oxophosphanium
SMILESO=[P+](O)Oc1cccc2c1Cc1ccccc1-2
InChIInChI=1S/C13H9O3P/c14-17(15)16-13-7-3-6-11-10-5-2-1-4-9(10)8-12(11)13/h1-7H,8H2/p+1
InChIKeyAVWKHAIOAQULDL-UHFFFAOYSA-O
XLogP3.29
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.19
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 9H-fluoren-1-yloxy-hydroxy-oxophosphanium?
The IUPAC name of 9H-fluoren-1-yloxy-hydroxy-oxophosphanium (CID 172827585) is 9H-fluoren-1-yloxy-hydroxy-oxophosphanium.
What is the SMILES notation for 9H-fluoren-1-yloxy-hydroxy-oxophosphanium?
The canonical SMILES for 9H-fluoren-1-yloxy-hydroxy-oxophosphanium is O=[P+](O)Oc1cccc2c1Cc1ccccc1-2.
What is the InChIKey of 9H-fluoren-1-yloxy-hydroxy-oxophosphanium?
The InChIKey is AVWKHAIOAQULDL-UHFFFAOYSA-O. The full InChI is InChI=1S/C13H9O3P/c14-17(15)16-13-7-3-6-11-10-5-2-1-4-9(10)8-12(11)13/h1-7H,8H2/p+1.
What are the key properties of 9H-fluoren-1-yloxy-hydroxy-oxophosphanium?
9H-fluoren-1-yloxy-hydroxy-oxophosphanium has a molecular weight of 245.19 g/mol, XLogP of 3.29, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9H-fluoren-1-yloxy-hydroxy-oxophosphanium is sourced from PubChem (CID 172827585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).