chloro-dimethyl-[9-[2-phenyl-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxyethoxy]nonyl]silane

C28H50ClNO2Si — CID 100969512

IUPACchloro-dimethyl-[9-[2-phenyl-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxyethoxy]nonyl]silane
SMILESCC1(C)CCCC(C)(C)N1OC(COCCCCCCCCC[Si](C)(C)Cl)c1ccccc1
InChIInChI=1S/C28H50ClNO2Si/c1-27(2)20-17-21-28(3,4)30(27)32-26(25-18-13-12-14-19-25)24-31-22-15-10-8-7-9-11-16-23-33(5,6)29/h12-14,18-19,26H,7-11,15-17,20-24H2,1-6H3
InChIKeyFGORZTNXPYMIAP-UHFFFAOYSA-N
MW496.25 g/mol
LogP8.89
Rot. Bonds15

About chloro-dimethyl-[9-[2-phenyl-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxyethoxy]nonyl]silane

chloro-dimethyl-[9-[2-phenyl-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxyethoxy]nonyl]silane (PubChem CID 100969512) has the molecular formula C28H50ClNO2Si and a molecular weight of 496.25 g/mol. Its IUPAC name is chloro-dimethyl-[9-[2-phenyl-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxyethoxy]nonyl]silane.

Molecular Properties

Compound Namechloro-dimethyl-[9-[2-phenyl-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxyethoxy]nonyl]silane
PubChem CID100969512
Molecular FormulaC28H50ClNO2Si
Molecular Weight496.25 g/mol
Exact Mass495.33
IUPAC Namechloro-dimethyl-[9-[2-phenyl-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxyethoxy]nonyl]silane
SMILESCC1(C)CCCC(C)(C)N1OC(COCCCCCCCCC[Si](C)(C)Cl)c1ccccc1
InChIInChI=1S/C28H50ClNO2Si/c1-27(2)20-17-21-28(3,4)30(27)32-26(25-18-13-12-14-19-25)24-31-22-15-10-8-7-9-11-16-23-33(5,6)29/h12-14,18-19,26H,7-11,15-17,20-24H2,1-6H3
InChIKeyFGORZTNXPYMIAP-UHFFFAOYSA-N
XLogP8.89
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds15
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500496.25
LogP ≤ 58.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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-dimethyl-[9-[2-phenyl-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxyethoxy]nonyl]silane?
The IUPAC name of chloro-dimethyl-[9-[2-phenyl-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxyethoxy]nonyl]silane (CID 100969512) is chloro-dimethyl-[9-[2-phenyl-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxyethoxy]nonyl]silane.
What is the SMILES notation for chloro-dimethyl-[9-[2-phenyl-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxyethoxy]nonyl]silane?
The canonical SMILES for chloro-dimethyl-[9-[2-phenyl-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxyethoxy]nonyl]silane is CC1(C)CCCC(C)(C)N1OC(COCCCCCCCCC[Si](C)(C)Cl)c1ccccc1.
What is the InChIKey of chloro-dimethyl-[9-[2-phenyl-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxyethoxy]nonyl]silane?
The InChIKey is FGORZTNXPYMIAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H50ClNO2Si/c1-27(2)20-17-21-28(3,4)30(27)32-26(25-18-13-12-14-19-25)24-31-22-15-10-8-7-9-11-16-23-33(5,6)29/h12-14,18-19,26H,7-11,15-17,20-24H2,1-6H3.
What are the key properties of chloro-dimethyl-[9-[2-phenyl-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxyethoxy]nonyl]silane?
chloro-dimethyl-[9-[2-phenyl-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxyethoxy]nonyl]silane has a molecular weight of 496.25 g/mol, XLogP of 8.89, 15 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-dimethyl-[9-[2-phenyl-2-(2,2,6,6-tetramethylpiperidin-1-yl)oxyethoxy]nonyl]silane is sourced from PubChem (CID 100969512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).