chloro-ethoxy-hexyl-methoxysilane

C9H21ClO2Si — CID 140745098

IUPACchloro-ethoxy-hexyl-methoxysilane
SMILESCCCCCC[Si](Cl)(OC)OCC
InChIInChI=1S/C9H21ClO2Si/c1-4-6-7-8-9-13(10,11-3)12-5-2/h4-9H2,1-3H3
InChIKeyWOFKFFPGWZQJLU-UHFFFAOYSA-N
MW224.80 g/mol
LogP3.43
Rot. Bonds8

About chloro-ethoxy-hexyl-methoxysilane

chloro-ethoxy-hexyl-methoxysilane (PubChem CID 140745098) has the molecular formula C9H21ClO2Si and a molecular weight of 224.80 g/mol. Its IUPAC name is chloro-ethoxy-hexyl-methoxysilane.

Molecular Properties

Compound Namechloro-ethoxy-hexyl-methoxysilane
PubChem CID140745098
Molecular FormulaC9H21ClO2Si
Molecular Weight224.80 g/mol
Exact Mass224.10
IUPAC Namechloro-ethoxy-hexyl-methoxysilane
SMILESCCCCCC[Si](Cl)(OC)OCC
InChIInChI=1S/C9H21ClO2Si/c1-4-6-7-8-9-13(10,11-3)12-5-2/h4-9H2,1-3H3
InChIKeyWOFKFFPGWZQJLU-UHFFFAOYSA-N
XLogP3.43
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.80
LogP ≤ 53.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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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Related Compounds

chloro-ethoxy-octyl-propoxysilane
CID 140744864
chloro-dodecyl-dioctoxysilane
CID 154096058
dodecyl-diethoxy-methoxysilane
CID 141483107
butyl-chloro-ethoxy-hexylsilane
CID 140745137
heptadecyl(trimethoxy)silane;triethoxy(heptadecyl)silane
CID 161331020
dichloro-hexyl-methoxysilane
CID 140744855
butyl-chloro-ethoxy-propoxysilane
CID 140745078
ethoxy-methoxy-propyl-tetradecylsilane
CID 141078244
decyl-diethoxy-tridecylsilane
CID 139614334
diethoxy-icosyl-undecylsilane
CID 139614143
diethoxy-hexadecyl-tridecylsilane
CID 139614117
diethoxy-heptadecyl-pentadecylsilane
CID 139614360

Frequently Asked Questions

What is the IUPAC name of chloro-ethoxy-hexyl-methoxysilane?
The IUPAC name of chloro-ethoxy-hexyl-methoxysilane (CID 140745098) is chloro-ethoxy-hexyl-methoxysilane.
What is the SMILES notation for chloro-ethoxy-hexyl-methoxysilane?
The canonical SMILES for chloro-ethoxy-hexyl-methoxysilane is CCCCCC[Si](Cl)(OC)OCC.
What is the InChIKey of chloro-ethoxy-hexyl-methoxysilane?
The InChIKey is WOFKFFPGWZQJLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21ClO2Si/c1-4-6-7-8-9-13(10,11-3)12-5-2/h4-9H2,1-3H3.
What are the key properties of chloro-ethoxy-hexyl-methoxysilane?
chloro-ethoxy-hexyl-methoxysilane has a molecular weight of 224.80 g/mol, XLogP of 3.43, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for chloro-ethoxy-hexyl-methoxysilane is sourced from PubChem (CID 140745098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).