cyclohexyl-dimethoxy-phenylsilane

C14H22O2Si — CID 54389963

IUPACcyclohexyl-dimethoxy-phenylsilane
SMILESCO[Si](OC)(c1ccccc1)C1CCCCC1
InChIInChI=1S/C14H22O2Si/c1-15-17(16-2,13-9-5-3-6-10-13)14-11-7-4-8-12-14/h3,5-6,9-10,14H,4,7-8,11-12H2,1-2H3
InChIKeyVFXWOOLNLDIWEP-UHFFFAOYSA-N
MW250.41 g/mol
LogP2.96
Rot. Bonds4

About cyclohexyl-dimethoxy-phenylsilane

cyclohexyl-dimethoxy-phenylsilane (PubChem CID 54389963) has the molecular formula C14H22O2Si and a molecular weight of 250.41 g/mol. Its IUPAC name is cyclohexyl-dimethoxy-phenylsilane.

Molecular Properties

Compound Namecyclohexyl-dimethoxy-phenylsilane
PubChem CID54389963
Molecular FormulaC14H22O2Si
Molecular Weight250.41 g/mol
Exact Mass250.14
IUPAC Namecyclohexyl-dimethoxy-phenylsilane
SMILESCO[Si](OC)(c1ccccc1)C1CCCCC1
InChIInChI=1S/C14H22O2Si/c1-15-17(16-2,13-9-5-3-6-10-13)14-11-7-4-8-12-14/h3,5-6,9-10,14H,4,7-8,11-12H2,1-2H3
InChIKeyVFXWOOLNLDIWEP-UHFFFAOYSA-N
XLogP2.96
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.41
LogP ≤ 52.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 cyclohexyl-dimethoxy-phenylsilane?
The IUPAC name of cyclohexyl-dimethoxy-phenylsilane (CID 54389963) is cyclohexyl-dimethoxy-phenylsilane.
What is the SMILES notation for cyclohexyl-dimethoxy-phenylsilane?
The canonical SMILES for cyclohexyl-dimethoxy-phenylsilane is CO[Si](OC)(c1ccccc1)C1CCCCC1.
What is the InChIKey of cyclohexyl-dimethoxy-phenylsilane?
The InChIKey is VFXWOOLNLDIWEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22O2Si/c1-15-17(16-2,13-9-5-3-6-10-13)14-11-7-4-8-12-14/h3,5-6,9-10,14H,4,7-8,11-12H2,1-2H3.
What are the key properties of cyclohexyl-dimethoxy-phenylsilane?
cyclohexyl-dimethoxy-phenylsilane has a molecular weight of 250.41 g/mol, XLogP of 2.96, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl-dimethoxy-phenylsilane is sourced from PubChem (CID 54389963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).