ethoxysilane;trichloro(octadecyl)silane

C20H45Cl3OSi2 — CID 158053635

IUPACethoxysilane;trichloro(octadecyl)silane
SMILESCCCCCCCCCCCCCCCCCC[Si](Cl)(Cl)Cl.CCO[SiH3]
InChIInChI=1S/C18H37Cl3Si.C2H8OSi/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22(19,20)21;1-2-3-4/h2-18H2,1H3;2H2,1,4H3
InChIKeyFJTVJAQPZUAKIE-UHFFFAOYSA-N
MW464.11 g/mol
LogP8.21
Rot. Bonds18

About ethoxysilane;trichloro(octadecyl)silane

ethoxysilane;trichloro(octadecyl)silane (PubChem CID 158053635) has the molecular formula C20H45Cl3OSi2 and a molecular weight of 464.11 g/mol. Its IUPAC name is ethoxysilane;trichloro(octadecyl)silane.

Molecular Properties

Compound Nameethoxysilane;trichloro(octadecyl)silane
PubChem CID158053635
Molecular FormulaC20H45Cl3OSi2
Molecular Weight464.11 g/mol
Exact Mass462.21
IUPAC Nameethoxysilane;trichloro(octadecyl)silane
SMILESCCCCCCCCCCCCCCCCCC[Si](Cl)(Cl)Cl.CCO[SiH3]
InChIInChI=1S/C18H37Cl3Si.C2H8OSi/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22(19,20)21;1-2-3-4/h2-18H2,1H3;2H2,1,4H3
InChIKeyFJTVJAQPZUAKIE-UHFFFAOYSA-N
XLogP8.21
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds18
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500464.11
LogP ≤ 58.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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

chlorosilane;trichloro(tetradecyl)silane
CID 159383155
trichloro(octyl)silane
CID 21354
ethoxysilane;hexadecyl(trimethoxy)silane
CID 162057078
trichloro(octadecyl)silane;trimethoxy(octadecyl)silane
CID 174467705
trichloro(3-chloropropyl)silane;trichloro(octyl)silane
CID 87989801
trichloro(octadecyl)silane;trimethoxy(methyl)silane
CID 174224724
trichloro(18-octadecylsilyloctadecyl)silane
CID 172795504
trichloro(9-trichlorosilylnonyl)silane
CID 10172893
2-methylheptane;trichloro(decyl)silane;hydrofluoride
CID 174930865
chloro-tri(nonyl)silane
CID 140826961
butyl-chloro-ethoxy-hexylsilane
CID 140745137
chloro-dimethyl-nonadecylsilane
CID 87338427

Frequently Asked Questions

What is the IUPAC name of ethoxysilane;trichloro(octadecyl)silane?
The IUPAC name of ethoxysilane;trichloro(octadecyl)silane (CID 158053635) is ethoxysilane;trichloro(octadecyl)silane.
What is the SMILES notation for ethoxysilane;trichloro(octadecyl)silane?
The canonical SMILES for ethoxysilane;trichloro(octadecyl)silane is CCCCCCCCCCCCCCCCCC[Si](Cl)(Cl)Cl.CCO[SiH3].
What is the InChIKey of ethoxysilane;trichloro(octadecyl)silane?
The InChIKey is FJTVJAQPZUAKIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H37Cl3Si.C2H8OSi/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22(19,20)21;1-2-3-4/h2-18H2,1H3;2H2,1,4H3.
What are the key properties of ethoxysilane;trichloro(octadecyl)silane?
ethoxysilane;trichloro(octadecyl)silane has a molecular weight of 464.11 g/mol, XLogP of 8.21, 18 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxysilane;trichloro(octadecyl)silane is sourced from PubChem (CID 158053635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).