[4-[(2-chlorophenyl)methoxymethyl]phenyl]-trimethylsilane

C17H21ClOSi — CID 103438617

IUPAC[4-[(2-chlorophenyl)methoxymethyl]phenyl]-trimethylsilane
SMILESC[Si](C)(C)c1ccc(COCc2ccccc2Cl)cc1
InChIInChI=1S/C17H21ClOSi/c1-20(2,3)16-10-8-14(9-11-16)12-19-13-15-6-4-5-7-17(15)18/h4-11H,12-13H2,1-3H3
InChIKeyCPRUVHYPCGWLTD-UHFFFAOYSA-N
MW304.89 g/mol
LogP4.60
Rot. Bonds5

About [4-[(2-chlorophenyl)methoxymethyl]phenyl]-trimethylsilane

[4-[(2-chlorophenyl)methoxymethyl]phenyl]-trimethylsilane (PubChem CID 103438617) has the molecular formula C17H21ClOSi and a molecular weight of 304.89 g/mol. Its IUPAC name is [4-[(2-chlorophenyl)methoxymethyl]phenyl]-trimethylsilane.

Molecular Properties

Compound Name[4-[(2-chlorophenyl)methoxymethyl]phenyl]-trimethylsilane
PubChem CID103438617
Molecular FormulaC17H21ClOSi
Molecular Weight304.89 g/mol
Exact Mass304.11
IUPAC Name[4-[(2-chlorophenyl)methoxymethyl]phenyl]-trimethylsilane
SMILESC[Si](C)(C)c1ccc(COCc2ccccc2Cl)cc1
InChIInChI=1S/C17H21ClOSi/c1-20(2,3)16-10-8-14(9-11-16)12-19-13-15-6-4-5-7-17(15)18/h4-11H,12-13H2,1-3H3
InChIKeyCPRUVHYPCGWLTD-UHFFFAOYSA-N
XLogP4.60
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.89
LogP ≤ 54.60
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 [4-[(2-chlorophenyl)methoxymethyl]phenyl]-trimethylsilane?
The IUPAC name of [4-[(2-chlorophenyl)methoxymethyl]phenyl]-trimethylsilane (CID 103438617) is [4-[(2-chlorophenyl)methoxymethyl]phenyl]-trimethylsilane.
What is the SMILES notation for [4-[(2-chlorophenyl)methoxymethyl]phenyl]-trimethylsilane?
The canonical SMILES for [4-[(2-chlorophenyl)methoxymethyl]phenyl]-trimethylsilane is C[Si](C)(C)c1ccc(COCc2ccccc2Cl)cc1.
What is the InChIKey of [4-[(2-chlorophenyl)methoxymethyl]phenyl]-trimethylsilane?
The InChIKey is CPRUVHYPCGWLTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21ClOSi/c1-20(2,3)16-10-8-14(9-11-16)12-19-13-15-6-4-5-7-17(15)18/h4-11H,12-13H2,1-3H3.
What are the key properties of [4-[(2-chlorophenyl)methoxymethyl]phenyl]-trimethylsilane?
[4-[(2-chlorophenyl)methoxymethyl]phenyl]-trimethylsilane has a molecular weight of 304.89 g/mol, XLogP of 4.60, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(2-chlorophenyl)methoxymethyl]phenyl]-trimethylsilane is sourced from PubChem (CID 103438617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).