1-[(Z)-2-[diiodo(phenyl)stannyl]ethenyl]cyclopentan-1-ol

C13H16I2OSn — CID 10721603

IUPAC1-[(Z)-2-[diiodo(phenyl)stannyl]ethenyl]cyclopentan-1-ol
SMILESOC1(/C=C\[Sn](I)(I)c2ccccc2)CCCC1
InChIInChI=1S/C7H11O.C6H5.2HI.Sn/c1-2-7(8)5-3-4-6-7;1-2-4-6-5-3-1;;;/h1-2,8H,3-6H2;1-5H;2*1H;/q;;;;+2/p-2
InChIKeyCZVCYDWTLBPDKU-UHFFFAOYSA-L
MW560.79 g/mol
LogP3.61
Rot. Bonds3

About 1-[(Z)-2-[diiodo(phenyl)stannyl]ethenyl]cyclopentan-1-ol

1-[(Z)-2-[diiodo(phenyl)stannyl]ethenyl]cyclopentan-1-ol (PubChem CID 10721603) has the molecular formula C13H16I2OSn and a molecular weight of 560.79 g/mol. Its IUPAC name is 1-[(Z)-2-[diiodo(phenyl)stannyl]ethenyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[(Z)-2-[diiodo(phenyl)stannyl]ethenyl]cyclopentan-1-ol
PubChem CID10721603
Molecular FormulaC13H16I2OSn
Molecular Weight560.79 g/mol
Exact Mass561.83
IUPAC Name1-[(Z)-2-[diiodo(phenyl)stannyl]ethenyl]cyclopentan-1-ol
SMILESOC1(/C=C\[Sn](I)(I)c2ccccc2)CCCC1
InChIInChI=1S/C7H11O.C6H5.2HI.Sn/c1-2-7(8)5-3-4-6-7;1-2-4-6-5-3-1;;;/h1-2,8H,3-6H2;1-5H;2*1H;/q;;;;+2/p-2
InChIKeyCZVCYDWTLBPDKU-UHFFFAOYSA-L
XLogP3.61
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500560.79
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-[(Z)-2-[diiodo(phenyl)stannyl]ethenyl]cyclopentan-1-ol?
The IUPAC name of 1-[(Z)-2-[diiodo(phenyl)stannyl]ethenyl]cyclopentan-1-ol (CID 10721603) is 1-[(Z)-2-[diiodo(phenyl)stannyl]ethenyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[(Z)-2-[diiodo(phenyl)stannyl]ethenyl]cyclopentan-1-ol?
The canonical SMILES for 1-[(Z)-2-[diiodo(phenyl)stannyl]ethenyl]cyclopentan-1-ol is OC1(/C=C\[Sn](I)(I)c2ccccc2)CCCC1.
What is the InChIKey of 1-[(Z)-2-[diiodo(phenyl)stannyl]ethenyl]cyclopentan-1-ol?
The InChIKey is CZVCYDWTLBPDKU-UHFFFAOYSA-L. The full InChI is InChI=1S/C7H11O.C6H5.2HI.Sn/c1-2-7(8)5-3-4-6-7;1-2-4-6-5-3-1;;;/h1-2,8H,3-6H2;1-5H;2*1H;/q;;;;+2/p-2.
What are the key properties of 1-[(Z)-2-[diiodo(phenyl)stannyl]ethenyl]cyclopentan-1-ol?
1-[(Z)-2-[diiodo(phenyl)stannyl]ethenyl]cyclopentan-1-ol has a molecular weight of 560.79 g/mol, XLogP of 3.61, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(Z)-2-[diiodo(phenyl)stannyl]ethenyl]cyclopentan-1-ol is sourced from PubChem (CID 10721603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).