[4-(chloromethyl)phenyl]-[dimethyl(phenyl)silyl]-dimethylsilane

C17H23ClSi2 — CID 20675770

IUPAC[4-(chloromethyl)phenyl]-[dimethyl(phenyl)silyl]-dimethylsilane
SMILESC[Si](C)(c1ccccc1)[Si](C)(C)c1ccc(CCl)cc1
InChIInChI=1S/C17H23ClSi2/c1-19(2,16-8-6-5-7-9-16)20(3,4)17-12-10-15(14-18)11-13-17/h5-13H,14H2,1-4H3
InChIKeyVKXGHTCRHAJQGE-UHFFFAOYSA-N
MW319.00 g/mol
LogP4.03
Rot. Bonds4

About [4-(chloromethyl)phenyl]-[dimethyl(phenyl)silyl]-dimethylsilane

[4-(chloromethyl)phenyl]-[dimethyl(phenyl)silyl]-dimethylsilane (PubChem CID 20675770) has the molecular formula C17H23ClSi2 and a molecular weight of 319.00 g/mol. Its IUPAC name is [4-(chloromethyl)phenyl]-[dimethyl(phenyl)silyl]-dimethylsilane.

Molecular Properties

Compound Name[4-(chloromethyl)phenyl]-[dimethyl(phenyl)silyl]-dimethylsilane
PubChem CID20675770
Molecular FormulaC17H23ClSi2
Molecular Weight319.00 g/mol
Exact Mass318.10
IUPAC Name[4-(chloromethyl)phenyl]-[dimethyl(phenyl)silyl]-dimethylsilane
SMILESC[Si](C)(c1ccccc1)[Si](C)(C)c1ccc(CCl)cc1
InChIInChI=1S/C17H23ClSi2/c1-19(2,16-8-6-5-7-9-16)20(3,4)17-12-10-15(14-18)11-13-17/h5-13H,14H2,1-4H3
InChIKeyVKXGHTCRHAJQGE-UHFFFAOYSA-N
XLogP4.03
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.00
LogP ≤ 54.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [4-(chloromethyl)phenyl]-[dimethyl(phenyl)silyl]-dimethylsilane?
The IUPAC name of [4-(chloromethyl)phenyl]-[dimethyl(phenyl)silyl]-dimethylsilane (CID 20675770) is [4-(chloromethyl)phenyl]-[dimethyl(phenyl)silyl]-dimethylsilane.
What is the SMILES notation for [4-(chloromethyl)phenyl]-[dimethyl(phenyl)silyl]-dimethylsilane?
The canonical SMILES for [4-(chloromethyl)phenyl]-[dimethyl(phenyl)silyl]-dimethylsilane is C[Si](C)(c1ccccc1)[Si](C)(C)c1ccc(CCl)cc1.
What is the InChIKey of [4-(chloromethyl)phenyl]-[dimethyl(phenyl)silyl]-dimethylsilane?
The InChIKey is VKXGHTCRHAJQGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23ClSi2/c1-19(2,16-8-6-5-7-9-16)20(3,4)17-12-10-15(14-18)11-13-17/h5-13H,14H2,1-4H3.
What are the key properties of [4-(chloromethyl)phenyl]-[dimethyl(phenyl)silyl]-dimethylsilane?
[4-(chloromethyl)phenyl]-[dimethyl(phenyl)silyl]-dimethylsilane has a molecular weight of 319.00 g/mol, XLogP of 4.03, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(chloromethyl)phenyl]-[dimethyl(phenyl)silyl]-dimethylsilane is sourced from PubChem (CID 20675770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).