[2-[(3-methoxyphenyl)methyl]phenyl]-trimethylsilane

C17H22OSi — CID 171716633

IUPAC[2-[(3-methoxyphenyl)methyl]phenyl]-trimethylsilane
SMILESCOc1cccc(Cc2ccccc2[Si](C)(C)C)c1
InChIInChI=1S/C17H22OSi/c1-18-16-10-7-8-14(13-16)12-15-9-5-6-11-17(15)19(2,3)4/h5-11,13H,12H2,1-4H3
InChIKeyFMEQRWHZFGTZPT-UHFFFAOYSA-N
MW270.45 g/mol
LogP3.83
Rot. Bonds4

About [2-[(3-methoxyphenyl)methyl]phenyl]-trimethylsilane

[2-[(3-methoxyphenyl)methyl]phenyl]-trimethylsilane (PubChem CID 171716633) has the molecular formula C17H22OSi and a molecular weight of 270.45 g/mol. Its IUPAC name is [2-[(3-methoxyphenyl)methyl]phenyl]-trimethylsilane.

Molecular Properties

Compound Name[2-[(3-methoxyphenyl)methyl]phenyl]-trimethylsilane
PubChem CID171716633
Molecular FormulaC17H22OSi
Molecular Weight270.45 g/mol
Exact Mass270.14
IUPAC Name[2-[(3-methoxyphenyl)methyl]phenyl]-trimethylsilane
SMILESCOc1cccc(Cc2ccccc2[Si](C)(C)C)c1
InChIInChI=1S/C17H22OSi/c1-18-16-10-7-8-14(13-16)12-15-9-5-6-11-17(15)19(2,3)4/h5-11,13H,12H2,1-4H3
InChIKeyFMEQRWHZFGTZPT-UHFFFAOYSA-N
XLogP3.83
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.45
LogP ≤ 53.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [2-[(3-methoxyphenyl)methyl]phenyl]-trimethylsilane?
The IUPAC name of [2-[(3-methoxyphenyl)methyl]phenyl]-trimethylsilane (CID 171716633) is [2-[(3-methoxyphenyl)methyl]phenyl]-trimethylsilane.
What is the SMILES notation for [2-[(3-methoxyphenyl)methyl]phenyl]-trimethylsilane?
The canonical SMILES for [2-[(3-methoxyphenyl)methyl]phenyl]-trimethylsilane is COc1cccc(Cc2ccccc2[Si](C)(C)C)c1.
What is the InChIKey of [2-[(3-methoxyphenyl)methyl]phenyl]-trimethylsilane?
The InChIKey is FMEQRWHZFGTZPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22OSi/c1-18-16-10-7-8-14(13-16)12-15-9-5-6-11-17(15)19(2,3)4/h5-11,13H,12H2,1-4H3.
What are the key properties of [2-[(3-methoxyphenyl)methyl]phenyl]-trimethylsilane?
[2-[(3-methoxyphenyl)methyl]phenyl]-trimethylsilane has a molecular weight of 270.45 g/mol, XLogP of 3.83, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(3-methoxyphenyl)methyl]phenyl]-trimethylsilane is sourced from PubChem (CID 171716633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).