chloro-(4-methylphenyl)silane

C7H9ClSi — CID 14919166

IUPACchloro-(4-methylphenyl)silane
SMILESCc1ccc([SiH2]Cl)cc1
InChIInChI=1S/C7H9ClSi/c1-6-2-4-7(9-8)5-3-6/h2-5H,9H2,1H3
InChIKeyNCYYWGYUWIWKLB-UHFFFAOYSA-N
MW156.69 g/mol
LogP0.94
Rot. Bonds1

About chloro-(4-methylphenyl)silane

chloro-(4-methylphenyl)silane (PubChem CID 14919166) has the molecular formula C7H9ClSi and a molecular weight of 156.69 g/mol. Its IUPAC name is chloro-(4-methylphenyl)silane.

Molecular Properties

Compound Namechloro-(4-methylphenyl)silane
PubChem CID14919166
Molecular FormulaC7H9ClSi
Molecular Weight156.69 g/mol
Exact Mass156.02
IUPAC Namechloro-(4-methylphenyl)silane
SMILESCc1ccc([SiH2]Cl)cc1
InChIInChI=1S/C7H9ClSi/c1-6-2-4-7(9-8)5-3-6/h2-5H,9H2,1H3
InChIKeyNCYYWGYUWIWKLB-UHFFFAOYSA-N
XLogP0.94
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.69
LogP ≤ 50.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of chloro-(4-methylphenyl)silane?
The IUPAC name of chloro-(4-methylphenyl)silane (CID 14919166) is chloro-(4-methylphenyl)silane.
What is the SMILES notation for chloro-(4-methylphenyl)silane?
The canonical SMILES for chloro-(4-methylphenyl)silane is Cc1ccc([SiH2]Cl)cc1.
What is the InChIKey of chloro-(4-methylphenyl)silane?
The InChIKey is NCYYWGYUWIWKLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9ClSi/c1-6-2-4-7(9-8)5-3-6/h2-5H,9H2,1H3.
What are the key properties of chloro-(4-methylphenyl)silane?
chloro-(4-methylphenyl)silane has a molecular weight of 156.69 g/mol, XLogP of 0.94, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-(4-methylphenyl)silane is sourced from PubChem (CID 14919166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).