cycloheptylmethyl-cyclohexyl-dimethoxysilane

C16H32O2Si — CID 18412967

IUPACcycloheptylmethyl-cyclohexyl-dimethoxysilane
SMILESCO[Si](CC1CCCCCC1)(OC)C1CCCCC1
InChIInChI=1S/C16H32O2Si/c1-17-19(18-2,16-12-8-5-9-13-16)14-15-10-6-3-4-7-11-15/h15-16H,3-14H2,1-2H3
InChIKeyGRGPYGNBEMNLPZ-UHFFFAOYSA-N
MW284.52 g/mol
LogP5.03
Rot. Bonds5

About cycloheptylmethyl-cyclohexyl-dimethoxysilane

cycloheptylmethyl-cyclohexyl-dimethoxysilane (PubChem CID 18412967) has the molecular formula C16H32O2Si and a molecular weight of 284.52 g/mol. Its IUPAC name is cycloheptylmethyl-cyclohexyl-dimethoxysilane.

Molecular Properties

Compound Namecycloheptylmethyl-cyclohexyl-dimethoxysilane
PubChem CID18412967
Molecular FormulaC16H32O2Si
Molecular Weight284.52 g/mol
Exact Mass284.22
IUPAC Namecycloheptylmethyl-cyclohexyl-dimethoxysilane
SMILESCO[Si](CC1CCCCCC1)(OC)C1CCCCC1
InChIInChI=1S/C16H32O2Si/c1-17-19(18-2,16-12-8-5-9-13-16)14-15-10-6-3-4-7-11-15/h15-16H,3-14H2,1-2H3
InChIKeyGRGPYGNBEMNLPZ-UHFFFAOYSA-N
XLogP5.03
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500284.52
LogP ≤ 55.03
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 cycloheptylmethyl-cyclohexyl-dimethoxysilane?
The IUPAC name of cycloheptylmethyl-cyclohexyl-dimethoxysilane (CID 18412967) is cycloheptylmethyl-cyclohexyl-dimethoxysilane.
What is the SMILES notation for cycloheptylmethyl-cyclohexyl-dimethoxysilane?
The canonical SMILES for cycloheptylmethyl-cyclohexyl-dimethoxysilane is CO[Si](CC1CCCCCC1)(OC)C1CCCCC1.
What is the InChIKey of cycloheptylmethyl-cyclohexyl-dimethoxysilane?
The InChIKey is GRGPYGNBEMNLPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32O2Si/c1-17-19(18-2,16-12-8-5-9-13-16)14-15-10-6-3-4-7-11-15/h15-16H,3-14H2,1-2H3.
What are the key properties of cycloheptylmethyl-cyclohexyl-dimethoxysilane?
cycloheptylmethyl-cyclohexyl-dimethoxysilane has a molecular weight of 284.52 g/mol, XLogP of 5.03, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cycloheptylmethyl-cyclohexyl-dimethoxysilane is sourced from PubChem (CID 18412967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).