[(Z)-1,2-bis(propylselanyl)ethenyl]benzene

C14H20Se2 — CID 15399225

IUPAC[(Z)-1,2-bis(propylselanyl)ethenyl]benzene
SMILESCCC[Se]/C=C(\[Se]CCC)c1ccccc1
InChIInChI=1S/C14H20Se2/c1-3-10-15-12-14(16-11-4-2)13-8-6-5-7-9-13/h5-9,12H,3-4,10-11H2,1-2H3/b14-12-
InChIKeyNXHVADMWLDXMJP-OWBHPGMISA-N
MW346.23 g/mol
LogP4.05
Rot. Bonds7

About [(Z)-1,2-bis(propylselanyl)ethenyl]benzene

[(Z)-1,2-bis(propylselanyl)ethenyl]benzene (PubChem CID 15399225) has the molecular formula C14H20Se2 and a molecular weight of 346.23 g/mol. Its IUPAC name is [(Z)-1,2-bis(propylselanyl)ethenyl]benzene.

Molecular Properties

Compound Name[(Z)-1,2-bis(propylselanyl)ethenyl]benzene
PubChem CID15399225
Molecular FormulaC14H20Se2
Molecular Weight346.23 g/mol
Exact Mass347.99
IUPAC Name[(Z)-1,2-bis(propylselanyl)ethenyl]benzene
SMILESCCC[Se]/C=C(\[Se]CCC)c1ccccc1
InChIInChI=1S/C14H20Se2/c1-3-10-15-12-14(16-11-4-2)13-8-6-5-7-9-13/h5-9,12H,3-4,10-11H2,1-2H3/b14-12-
InChIKeyNXHVADMWLDXMJP-OWBHPGMISA-N
XLogP4.05
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.23
LogP ≤ 54.05
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)-1,2-bis(methylselanyl)ethenyl]benzene
CID 15635882
Se-butyl benzenecarboselenoate
CID 10399421
1-fluorobut-1-en-2-ylbenzene
CID 67823152
2,2-diphenylethenyl(ethyl)silane
CID 154128110
1-methoxybut-1-enylbenzene
CID 69305429
[(E)-hept-2-en-3-yl]benzene
CID 14568345
[(E)-1,2-dichloro-2-ethylselanylethenyl]benzene
CID 10588787
(Z)-1-phenylpent-1-en-1-amine
CID 22065568
2,2-diphenylethenyl-ethyl-phenylphosphane
CID 174770397
[(E)-but-2-en-2-yl]benzene;ethane;propane
CID 144534728
(Z)-2-phenylbut-1-en-1-amine
CID 142213019
pent-1-en-2-ylbenzene
CID 521761

Frequently Asked Questions

What is the IUPAC name of [(Z)-1,2-bis(propylselanyl)ethenyl]benzene?
The IUPAC name of [(Z)-1,2-bis(propylselanyl)ethenyl]benzene (CID 15399225) is [(Z)-1,2-bis(propylselanyl)ethenyl]benzene.
What is the SMILES notation for [(Z)-1,2-bis(propylselanyl)ethenyl]benzene?
The canonical SMILES for [(Z)-1,2-bis(propylselanyl)ethenyl]benzene is CCC[Se]/C=C(\[Se]CCC)c1ccccc1.
What is the InChIKey of [(Z)-1,2-bis(propylselanyl)ethenyl]benzene?
The InChIKey is NXHVADMWLDXMJP-OWBHPGMISA-N. The full InChI is InChI=1S/C14H20Se2/c1-3-10-15-12-14(16-11-4-2)13-8-6-5-7-9-13/h5-9,12H,3-4,10-11H2,1-2H3/b14-12-.
What are the key properties of [(Z)-1,2-bis(propylselanyl)ethenyl]benzene?
[(Z)-1,2-bis(propylselanyl)ethenyl]benzene has a molecular weight of 346.23 g/mol, XLogP of 4.05, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-1,2-bis(propylselanyl)ethenyl]benzene is sourced from PubChem (CID 15399225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).