[(Z)-1-iodo-2-(2-methylphenyl)ethenyl]-trimethylsilane

C12H17ISi — CID 102521364

IUPAC[(Z)-1-iodo-2-(2-methylphenyl)ethenyl]-trimethylsilane
SMILESCc1ccccc1/C=C(\I)[Si](C)(C)C
InChIInChI=1S/C12H17ISi/c1-10-7-5-6-8-11(10)9-12(13)14(2,3)4/h5-9H,1-4H3/b12-9+
InChIKeyUCCCOVBOBPYTMS-FMIVXFBMSA-N
MW316.26 g/mol
LogP4.65
Rot. Bonds2

About [(Z)-1-iodo-2-(2-methylphenyl)ethenyl]-trimethylsilane

[(Z)-1-iodo-2-(2-methylphenyl)ethenyl]-trimethylsilane (PubChem CID 102521364) has the molecular formula C12H17ISi and a molecular weight of 316.26 g/mol. Its IUPAC name is [(Z)-1-iodo-2-(2-methylphenyl)ethenyl]-trimethylsilane.

Molecular Properties

Compound Name[(Z)-1-iodo-2-(2-methylphenyl)ethenyl]-trimethylsilane
PubChem CID102521364
Molecular FormulaC12H17ISi
Molecular Weight316.26 g/mol
Exact Mass316.01
IUPAC Name[(Z)-1-iodo-2-(2-methylphenyl)ethenyl]-trimethylsilane
SMILESCc1ccccc1/C=C(\I)[Si](C)(C)C
InChIInChI=1S/C12H17ISi/c1-10-7-5-6-8-11(10)9-12(13)14(2,3)4/h5-9H,1-4H3/b12-9+
InChIKeyUCCCOVBOBPYTMS-FMIVXFBMSA-N
XLogP4.65
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.26
LogP ≤ 54.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [(Z)-1-iodo-2-(2-methylphenyl)ethenyl]-trimethylsilane?
The IUPAC name of [(Z)-1-iodo-2-(2-methylphenyl)ethenyl]-trimethylsilane (CID 102521364) is [(Z)-1-iodo-2-(2-methylphenyl)ethenyl]-trimethylsilane.
What is the SMILES notation for [(Z)-1-iodo-2-(2-methylphenyl)ethenyl]-trimethylsilane?
The canonical SMILES for [(Z)-1-iodo-2-(2-methylphenyl)ethenyl]-trimethylsilane is Cc1ccccc1/C=C(\I)[Si](C)(C)C.
What is the InChIKey of [(Z)-1-iodo-2-(2-methylphenyl)ethenyl]-trimethylsilane?
The InChIKey is UCCCOVBOBPYTMS-FMIVXFBMSA-N. The full InChI is InChI=1S/C12H17ISi/c1-10-7-5-6-8-11(10)9-12(13)14(2,3)4/h5-9H,1-4H3/b12-9+.
What are the key properties of [(Z)-1-iodo-2-(2-methylphenyl)ethenyl]-trimethylsilane?
[(Z)-1-iodo-2-(2-methylphenyl)ethenyl]-trimethylsilane has a molecular weight of 316.26 g/mol, XLogP of 4.65, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-1-iodo-2-(2-methylphenyl)ethenyl]-trimethylsilane is sourced from PubChem (CID 102521364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).