4-fluoren-9-ylidene-3,5-dioxa-4λ5-phosphatricyclo[5.3.1.04,11]undeca-1(11),7,9-triene

C21H15O2P — CID 23417235

IUPAC4-fluoren-9-ylidene-3,5-dioxa-4λ5-phosphatricyclo[5.3.1.04,11]undeca-1(11),7,9-triene
SMILESc1cc2c3c(c1)COP3(=C1c3ccccc3-c3ccccc31)OC2
InChIInChI=1S/C21H15O2P/c1-3-10-18-16(8-1)17-9-2-4-11-19(17)21(18)24-20-14(12-22-24)6-5-7-15(20)13-23-24/h1-11H,12-13H2
InChIKeyZXPKCZLHIAPODO-UHFFFAOYSA-N
MW330.32 g/mol
LogP4.47
Rot. Bonds

About 4-fluoren-9-ylidene-3,5-dioxa-4λ5-phosphatricyclo[5.3.1.04,11]undeca-1(11),7,9-triene

4-fluoren-9-ylidene-3,5-dioxa-4λ5-phosphatricyclo[5.3.1.04,11]undeca-1(11),7,9-triene (PubChem CID 23417235) has the molecular formula C21H15O2P and a molecular weight of 330.32 g/mol. Its IUPAC name is 4-fluoren-9-ylidene-3,5-dioxa-4λ5-phosphatricyclo[5.3.1.04,11]undeca-1(11),7,9-triene.

Molecular Properties

Compound Name4-fluoren-9-ylidene-3,5-dioxa-4λ5-phosphatricyclo[5.3.1.04,11]undeca-1(11),7,9-triene
PubChem CID23417235
Molecular FormulaC21H15O2P
Molecular Weight330.32 g/mol
Exact Mass330.08
IUPAC Name4-fluoren-9-ylidene-3,5-dioxa-4λ5-phosphatricyclo[5.3.1.04,11]undeca-1(11),7,9-triene
SMILESc1cc2c3c(c1)COP3(=C1c3ccccc3-c3ccccc31)OC2
InChIInChI=1S/C21H15O2P/c1-3-10-18-16(8-1)17-9-2-4-11-19(17)21(18)24-20-14(12-22-24)6-5-7-15(20)13-23-24/h1-11H,12-13H2
InChIKeyZXPKCZLHIAPODO-UHFFFAOYSA-N
XLogP4.47
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.32
LogP ≤ 54.47
H-Bond Donors ≤ 50
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 4-fluoren-9-ylidene-3,5-dioxa-4λ5-phosphatricyclo[5.3.1.04,11]undeca-1(11),7,9-triene?
The IUPAC name of 4-fluoren-9-ylidene-3,5-dioxa-4λ5-phosphatricyclo[5.3.1.04,11]undeca-1(11),7,9-triene (CID 23417235) is 4-fluoren-9-ylidene-3,5-dioxa-4λ5-phosphatricyclo[5.3.1.04,11]undeca-1(11),7,9-triene.
What is the SMILES notation for 4-fluoren-9-ylidene-3,5-dioxa-4λ5-phosphatricyclo[5.3.1.04,11]undeca-1(11),7,9-triene?
The canonical SMILES for 4-fluoren-9-ylidene-3,5-dioxa-4λ5-phosphatricyclo[5.3.1.04,11]undeca-1(11),7,9-triene is c1cc2c3c(c1)COP3(=C1c3ccccc3-c3ccccc31)OC2.
What is the InChIKey of 4-fluoren-9-ylidene-3,5-dioxa-4λ5-phosphatricyclo[5.3.1.04,11]undeca-1(11),7,9-triene?
The InChIKey is ZXPKCZLHIAPODO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H15O2P/c1-3-10-18-16(8-1)17-9-2-4-11-19(17)21(18)24-20-14(12-22-24)6-5-7-15(20)13-23-24/h1-11H,12-13H2.
What are the key properties of 4-fluoren-9-ylidene-3,5-dioxa-4λ5-phosphatricyclo[5.3.1.04,11]undeca-1(11),7,9-triene?
4-fluoren-9-ylidene-3,5-dioxa-4λ5-phosphatricyclo[5.3.1.04,11]undeca-1(11),7,9-triene has a molecular weight of 330.32 g/mol, XLogP of 4.47, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoren-9-ylidene-3,5-dioxa-4λ5-phosphatricyclo[5.3.1.04,11]undeca-1(11),7,9-triene is sourced from PubChem (CID 23417235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).