9-ethenylxanthen-9-ol

C15H12O2 — CID 19261468

IUPAC9-ethenylxanthen-9-ol
SMILESC=CC1(O)c2ccccc2Oc2ccccc21
InChIInChI=1S/C15H12O2/c1-2-15(16)11-7-3-5-9-13(11)17-14-10-6-4-8-12(14)15/h2-10,16H,1H2
InChIKeyMUYYIQLBDFTVGE-UHFFFAOYSA-N
MW224.26 g/mol
LogP3.21
Rot. Bonds1

About 9-ethenylxanthen-9-ol

9-ethenylxanthen-9-ol (PubChem CID 19261468) has the molecular formula C15H12O2 and a molecular weight of 224.26 g/mol. Its IUPAC name is 9-ethenylxanthen-9-ol.

Molecular Properties

Compound Name9-ethenylxanthen-9-ol
PubChem CID19261468
Molecular FormulaC15H12O2
Molecular Weight224.26 g/mol
Exact Mass224.08
IUPAC Name9-ethenylxanthen-9-ol
SMILESC=CC1(O)c2ccccc2Oc2ccccc21
InChIInChI=1S/C15H12O2/c1-2-15(16)11-7-3-5-9-13(11)17-14-10-6-4-8-12(14)15/h2-10,16H,1H2
InChIKeyMUYYIQLBDFTVGE-UHFFFAOYSA-N
XLogP3.21
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 9-ethenylxanthen-9-ol?
The IUPAC name of 9-ethenylxanthen-9-ol (CID 19261468) is 9-ethenylxanthen-9-ol.
What is the SMILES notation for 9-ethenylxanthen-9-ol?
The canonical SMILES for 9-ethenylxanthen-9-ol is C=CC1(O)c2ccccc2Oc2ccccc21.
What is the InChIKey of 9-ethenylxanthen-9-ol?
The InChIKey is MUYYIQLBDFTVGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12O2/c1-2-15(16)11-7-3-5-9-13(11)17-14-10-6-4-8-12(14)15/h2-10,16H,1H2.
What are the key properties of 9-ethenylxanthen-9-ol?
9-ethenylxanthen-9-ol has a molecular weight of 224.26 g/mol, XLogP of 3.21, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-ethenylxanthen-9-ol is sourced from PubChem (CID 19261468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).