4-methoxy-2-phenyl-4H-selenochromene

C16H14OSe — CID 15495831

IUPAC4-methoxy-2-phenyl-4H-selenochromene
SMILESCOC1C=C(c2ccccc2)[Se]c2ccccc21
InChIInChI=1S/C16H14OSe/c1-17-14-11-16(12-7-3-2-4-8-12)18-15-10-6-5-9-13(14)15/h2-11,14H,1H3
InChIKeySLYVOSLQFSUMKK-UHFFFAOYSA-N
MW301.25 g/mol
LogP2.76
Rot. Bonds2

About 4-methoxy-2-phenyl-4H-selenochromene

4-methoxy-2-phenyl-4H-selenochromene (PubChem CID 15495831) has the molecular formula C16H14OSe and a molecular weight of 301.25 g/mol. Its IUPAC name is 4-methoxy-2-phenyl-4H-selenochromene.

Molecular Properties

Compound Name4-methoxy-2-phenyl-4H-selenochromene
PubChem CID15495831
Molecular FormulaC16H14OSe
Molecular Weight301.25 g/mol
Exact Mass302.02
IUPAC Name4-methoxy-2-phenyl-4H-selenochromene
SMILESCOC1C=C(c2ccccc2)[Se]c2ccccc21
InChIInChI=1S/C16H14OSe/c1-17-14-11-16(12-7-3-2-4-8-12)18-15-10-6-5-9-13(14)15/h2-11,14H,1H3
InChIKeySLYVOSLQFSUMKK-UHFFFAOYSA-N
XLogP2.76
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.25
LogP ≤ 52.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-phenyl-4H-selenochromene?
The IUPAC name of 4-methoxy-2-phenyl-4H-selenochromene (CID 15495831) is 4-methoxy-2-phenyl-4H-selenochromene.
What is the SMILES notation for 4-methoxy-2-phenyl-4H-selenochromene?
The canonical SMILES for 4-methoxy-2-phenyl-4H-selenochromene is COC1C=C(c2ccccc2)[Se]c2ccccc21.
What is the InChIKey of 4-methoxy-2-phenyl-4H-selenochromene?
The InChIKey is SLYVOSLQFSUMKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14OSe/c1-17-14-11-16(12-7-3-2-4-8-12)18-15-10-6-5-9-13(14)15/h2-11,14H,1H3.
What are the key properties of 4-methoxy-2-phenyl-4H-selenochromene?
4-methoxy-2-phenyl-4H-selenochromene has a molecular weight of 301.25 g/mol, XLogP of 2.76, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-phenyl-4H-selenochromene is sourced from PubChem (CID 15495831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).