[(Z)-1-phenylselanyloct-2-en-2-yl]selanylbenzene

C20H24Se2 — CID 54763336

IUPAC[(Z)-1-phenylselanyloct-2-en-2-yl]selanylbenzene
SMILESCCCCC/C=C(/C[Se]c1ccccc1)[Se]c1ccccc1
InChIInChI=1S/C20H24Se2/c1-2-3-4-7-16-20(22-19-14-10-6-11-15-19)17-21-18-12-8-5-9-13-18/h5-6,8-16H,2-4,7,17H2,1H3/b20-16-
InChIKeyNJPYYEGGHACPBS-SILNSSARSA-N
MW422.33 g/mol
LogP3.93
Rot. Bonds9

About [(Z)-1-phenylselanyloct-2-en-2-yl]selanylbenzene

[(Z)-1-phenylselanyloct-2-en-2-yl]selanylbenzene (PubChem CID 54763336) has the molecular formula C20H24Se2 and a molecular weight of 422.33 g/mol. Its IUPAC name is [(Z)-1-phenylselanyloct-2-en-2-yl]selanylbenzene.

Molecular Properties

Compound Name[(Z)-1-phenylselanyloct-2-en-2-yl]selanylbenzene
PubChem CID54763336
Molecular FormulaC20H24Se2
Molecular Weight422.33 g/mol
Exact Mass424.02
IUPAC Name[(Z)-1-phenylselanyloct-2-en-2-yl]selanylbenzene
SMILESCCCCC/C=C(/C[Se]c1ccccc1)[Se]c1ccccc1
InChIInChI=1S/C20H24Se2/c1-2-3-4-7-16-20(22-19-14-10-6-11-15-19)17-21-18-12-8-5-9-13-18/h5-6,8-16H,2-4,7,17H2,1H3/b20-16-
InChIKeyNJPYYEGGHACPBS-SILNSSARSA-N
XLogP3.93
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.33
LogP ≤ 53.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

[(E)-non-3-en-3-yl]selanylbenzene
CID 102123205
[(Z)-dodec-5-en-5-yl]selanylbenzene
CID 134921010
[(E)-dec-5-en-5-yl]selanylbenzene
CID 12741495
(E)-3-phenylselanylnon-3-en-2-ol
CID 177482201
tributyl-[(E)-1-phenylselanylhept-1-enyl]stannane
CID 15314212
[(Z)-2,3-bis(phenylselanyl)prop-1-enyl]benzene
CID 102573736
Se-phenyl (Z)-3-phenylselanylnon-2-eneselenoate
CID 10575525
1-chloro-4-[(E)-1-phenylselanylhex-1-enyl]benzene
CID 11337041
(E)-1-phenyl-2-(phenylselanylmethyl)non-1-en-3-one
CID 177396673
sodium;hydride;1-phenyltetradec-1-enylbenzene
CID 173018182
2-phenylundec-2-ene-1-thiol
CID 175069404
(2S)-1-phenylselanyloctan-2-ol
CID 71415328

Frequently Asked Questions

What is the IUPAC name of [(Z)-1-phenylselanyloct-2-en-2-yl]selanylbenzene?
The IUPAC name of [(Z)-1-phenylselanyloct-2-en-2-yl]selanylbenzene (CID 54763336) is [(Z)-1-phenylselanyloct-2-en-2-yl]selanylbenzene.
What is the SMILES notation for [(Z)-1-phenylselanyloct-2-en-2-yl]selanylbenzene?
The canonical SMILES for [(Z)-1-phenylselanyloct-2-en-2-yl]selanylbenzene is CCCCC/C=C(/C[Se]c1ccccc1)[Se]c1ccccc1.
What is the InChIKey of [(Z)-1-phenylselanyloct-2-en-2-yl]selanylbenzene?
The InChIKey is NJPYYEGGHACPBS-SILNSSARSA-N. The full InChI is InChI=1S/C20H24Se2/c1-2-3-4-7-16-20(22-19-14-10-6-11-15-19)17-21-18-12-8-5-9-13-18/h5-6,8-16H,2-4,7,17H2,1H3/b20-16-.
What are the key properties of [(Z)-1-phenylselanyloct-2-en-2-yl]selanylbenzene?
[(Z)-1-phenylselanyloct-2-en-2-yl]selanylbenzene has a molecular weight of 422.33 g/mol, XLogP of 3.93, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-1-phenylselanyloct-2-en-2-yl]selanylbenzene is sourced from PubChem (CID 54763336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).