tributyl-[(2E,4Z)-5-phenylpenta-2,4-dien-2-yl]stannane

C23H38Sn — CID 11212663

IUPACtributyl-[(2E,4Z)-5-phenylpenta-2,4-dien-2-yl]stannane
SMILESCCCC[Sn](CCCC)(CCCC)/C(C)=C/C=C\c1ccccc1
InChIInChI=1S/C11H11.3C4H9.Sn/c1-2-3-5-8-11-9-6-4-7-10-11;3*1-3-4-2;/h3-10H,1H3;3*1,3-4H2,2H3;/b3-2?,8-5-;;;;
InChIKeyQILKBYAYZUADTE-NSEWNGHDSA-N
MW433.27 g/mol
LogP8.03
Rot. Bonds12

About tributyl-[(2E,4Z)-5-phenylpenta-2,4-dien-2-yl]stannane

tributyl-[(2E,4Z)-5-phenylpenta-2,4-dien-2-yl]stannane (PubChem CID 11212663) has the molecular formula C23H38Sn and a molecular weight of 433.27 g/mol. Its IUPAC name is tributyl-[(2E,4Z)-5-phenylpenta-2,4-dien-2-yl]stannane.

Molecular Properties

Compound Nametributyl-[(2E,4Z)-5-phenylpenta-2,4-dien-2-yl]stannane
PubChem CID11212663
Molecular FormulaC23H38Sn
Molecular Weight433.27 g/mol
Exact Mass434.20
IUPAC Nametributyl-[(2E,4Z)-5-phenylpenta-2,4-dien-2-yl]stannane
SMILESCCCC[Sn](CCCC)(CCCC)/C(C)=C/C=C\c1ccccc1
InChIInChI=1S/C11H11.3C4H9.Sn/c1-2-3-5-8-11-9-6-4-7-10-11;3*1-3-4-2;/h3-10H,1H3;3*1,3-4H2,2H3;/b3-2?,8-5-;;;;
InChIKeyQILKBYAYZUADTE-NSEWNGHDSA-N
XLogP8.03
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds12
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500433.27
LogP ≤ 58.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

[(1E,3E)-4-methylocta-1,3-dienyl]benzene
CID 13273746
tributyl-[(E)-1-fluoro-2-phenylethenyl]stannane
CID 10862504
[(1E,3E)-1-butoxy-4-phenylbuta-1,3-dienyl]benzene
CID 87886241
(1-butoxy-4-phenylbuta-1,3-dienyl)benzene
CID 90913634
4-methylpenta-1,3-dienylbenzene
CID 3614395
[(3Z)-octa-1,3-dienyl]benzene
CID 154692518
(5-chloro-4-methylpenta-1,3-dienyl)benzene
CID 79323612
pentan-1-ol;(E)-stilbene
CID 172553874
(3-methyl-6-phenylhexa-1,3,5-trienyl)benzene
CID 618811
(1E,3E)-1-phenylundeca-1,3-dien-5-one
CID 5373541
tributyl-[(E)-1-butyltellanyl-2-phenylethenyl]stannane
CID 10507405
tributylstannyl (E)-3-phenylprop-2-enoate
CID 16687405

Frequently Asked Questions

What is the IUPAC name of tributyl-[(2E,4Z)-5-phenylpenta-2,4-dien-2-yl]stannane?
The IUPAC name of tributyl-[(2E,4Z)-5-phenylpenta-2,4-dien-2-yl]stannane (CID 11212663) is tributyl-[(2E,4Z)-5-phenylpenta-2,4-dien-2-yl]stannane.
What is the SMILES notation for tributyl-[(2E,4Z)-5-phenylpenta-2,4-dien-2-yl]stannane?
The canonical SMILES for tributyl-[(2E,4Z)-5-phenylpenta-2,4-dien-2-yl]stannane is CCCC[Sn](CCCC)(CCCC)/C(C)=C/C=C\c1ccccc1.
What is the InChIKey of tributyl-[(2E,4Z)-5-phenylpenta-2,4-dien-2-yl]stannane?
The InChIKey is QILKBYAYZUADTE-NSEWNGHDSA-N. The full InChI is InChI=1S/C11H11.3C4H9.Sn/c1-2-3-5-8-11-9-6-4-7-10-11;3*1-3-4-2;/h3-10H,1H3;3*1,3-4H2,2H3;/b3-2?,8-5-;;;;.
What are the key properties of tributyl-[(2E,4Z)-5-phenylpenta-2,4-dien-2-yl]stannane?
tributyl-[(2E,4Z)-5-phenylpenta-2,4-dien-2-yl]stannane has a molecular weight of 433.27 g/mol, XLogP of 8.03, 12 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tributyl-[(2E,4Z)-5-phenylpenta-2,4-dien-2-yl]stannane is sourced from PubChem (CID 11212663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).