chloro-(4-ethylphenyl)silane

C8H11ClSi — CID 123146480

IUPACchloro-(4-ethylphenyl)silane
SMILESCCc1ccc([SiH2]Cl)cc1
InChIInChI=1S/C8H11ClSi/c1-2-7-3-5-8(10-9)6-4-7/h3-6H,2,10H2,1H3
InChIKeyJKFAIERFMFBVJQ-UHFFFAOYSA-N
MW170.72 g/mol
LogP1.20
Rot. Bonds2

About chloro-(4-ethylphenyl)silane

chloro-(4-ethylphenyl)silane (PubChem CID 123146480) has the molecular formula C8H11ClSi and a molecular weight of 170.72 g/mol. Its IUPAC name is chloro-(4-ethylphenyl)silane.

Molecular Properties

Compound Namechloro-(4-ethylphenyl)silane
PubChem CID123146480
Molecular FormulaC8H11ClSi
Molecular Weight170.72 g/mol
Exact Mass170.03
IUPAC Namechloro-(4-ethylphenyl)silane
SMILESCCc1ccc([SiH2]Cl)cc1
InChIInChI=1S/C8H11ClSi/c1-2-7-3-5-8(10-9)6-4-7/h3-6H,2,10H2,1H3
InChIKeyJKFAIERFMFBVJQ-UHFFFAOYSA-N
XLogP1.20
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.72
LogP ≤ 51.20
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-ethylphenyl)silane?
The IUPAC name of chloro-(4-ethylphenyl)silane (CID 123146480) is chloro-(4-ethylphenyl)silane.
What is the SMILES notation for chloro-(4-ethylphenyl)silane?
The canonical SMILES for chloro-(4-ethylphenyl)silane is CCc1ccc([SiH2]Cl)cc1.
What is the InChIKey of chloro-(4-ethylphenyl)silane?
The InChIKey is JKFAIERFMFBVJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11ClSi/c1-2-7-3-5-8(10-9)6-4-7/h3-6H,2,10H2,1H3.
What are the key properties of chloro-(4-ethylphenyl)silane?
chloro-(4-ethylphenyl)silane has a molecular weight of 170.72 g/mol, XLogP of 1.20, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-(4-ethylphenyl)silane is sourced from PubChem (CID 123146480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).