cyclopentylmethyl-diethoxy-(2-ethylhexyl)silane

C18H38O2Si — CID 18413003

IUPACcyclopentylmethyl-diethoxy-(2-ethylhexyl)silane
SMILESCCCCC(CC)C[Si](CC1CCCC1)(OCC)OCC
InChIInChI=1S/C18H38O2Si/c1-5-9-12-17(6-2)15-21(19-7-3,20-8-4)16-18-13-10-11-14-18/h17-18H,5-16H2,1-4H3
InChIKeyRYNSRWNDQWLZPP-UHFFFAOYSA-N
MW314.59 g/mol
LogP5.91
Rot. Bonds12

About cyclopentylmethyl-diethoxy-(2-ethylhexyl)silane

cyclopentylmethyl-diethoxy-(2-ethylhexyl)silane (PubChem CID 18413003) has the molecular formula C18H38O2Si and a molecular weight of 314.59 g/mol. Its IUPAC name is cyclopentylmethyl-diethoxy-(2-ethylhexyl)silane.

Molecular Properties

Compound Namecyclopentylmethyl-diethoxy-(2-ethylhexyl)silane
PubChem CID18413003
Molecular FormulaC18H38O2Si
Molecular Weight314.59 g/mol
Exact Mass314.26
IUPAC Namecyclopentylmethyl-diethoxy-(2-ethylhexyl)silane
SMILESCCCCC(CC)C[Si](CC1CCCC1)(OCC)OCC
InChIInChI=1S/C18H38O2Si/c1-5-9-12-17(6-2)15-21(19-7-3,20-8-4)16-18-13-10-11-14-18/h17-18H,5-16H2,1-4H3
InChIKeyRYNSRWNDQWLZPP-UHFFFAOYSA-N
XLogP5.91
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500314.59
LogP ≤ 55.91
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 cyclopentylmethyl-diethoxy-(2-ethylhexyl)silane?
The IUPAC name of cyclopentylmethyl-diethoxy-(2-ethylhexyl)silane (CID 18413003) is cyclopentylmethyl-diethoxy-(2-ethylhexyl)silane.
What is the SMILES notation for cyclopentylmethyl-diethoxy-(2-ethylhexyl)silane?
The canonical SMILES for cyclopentylmethyl-diethoxy-(2-ethylhexyl)silane is CCCCC(CC)C[Si](CC1CCCC1)(OCC)OCC.
What is the InChIKey of cyclopentylmethyl-diethoxy-(2-ethylhexyl)silane?
The InChIKey is RYNSRWNDQWLZPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H38O2Si/c1-5-9-12-17(6-2)15-21(19-7-3,20-8-4)16-18-13-10-11-14-18/h17-18H,5-16H2,1-4H3.
What are the key properties of cyclopentylmethyl-diethoxy-(2-ethylhexyl)silane?
cyclopentylmethyl-diethoxy-(2-ethylhexyl)silane has a molecular weight of 314.59 g/mol, XLogP of 5.91, 12 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentylmethyl-diethoxy-(2-ethylhexyl)silane is sourced from PubChem (CID 18413003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).