benzylethoxysilane

C9H11OSi — CID 66773279

IUPAC—
SMILES[Si]OCCCc1ccccc1
InChIInChI=1S/C9H11OSi/c11-10-8-4-7-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2
InChIKeyHSXBGIPEAMYZDK-UHFFFAOYSA-N
MW163.27 g/mol
LogP1.72
Rot. Bonds4

About benzylethoxysilane

benzylethoxysilane (PubChem CID 66773279) has the molecular formula C9H11OSi and a molecular weight of 163.27 g/mol.

Molecular Properties

Compound Namebenzylethoxysilane
PubChem CID66773279
Molecular FormulaC9H11OSi
Molecular Weight163.27 g/mol
Exact Mass163.06
IUPAC Name—
SMILES[Si]OCCCc1ccccc1
InChIInChI=1S/C9H11OSi/c11-10-8-4-7-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2
InChIKeyHSXBGIPEAMYZDK-UHFFFAOYSA-N
XLogP1.72
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.27
LogP ≤ 51.72
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'}

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Related Compounds

4-phenylbutylbenzene
CID 141301927
1,4-bis(3-phenylpropyl)benzene
CID 59467322
hafnium;4-phenylbutylbenzene
CID 175889972
methane;4-phenylbutylbenzene
CID 173386802
CID 159131095
CID 159131095
8-(8-phenyloctoxy)octylbenzene
CID 56628536
3-phenylperoxypropylbenzene
CID 88815818
oxo(3-phenylpropoxy)stannane
CID 173066095
3-(chloroamino)oxypropylbenzene
CID 140980785
2-[2-[2-[2-(3-phenylpropoxy)ethoxy]ethoxy]ethoxy]ethanamine
CID 138496429
1-phenyl-N-(3-phenylpropoxy)methanamine
CID 154375568
methyl-(3-phenylpropyl)-silyloxysilane
CID 173064055

Frequently Asked Questions

What is the IUPAC name of benzylethoxysilane?
The IUPAC name of benzylethoxysilane (CID 66773279) is not available.
What is the SMILES notation for benzylethoxysilane?
The canonical SMILES for benzylethoxysilane is [Si]OCCCc1ccccc1.
What is the InChIKey of benzylethoxysilane?
The InChIKey is HSXBGIPEAMYZDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11OSi/c11-10-8-4-7-9-5-2-1-3-6-9/h1-3,5-6H,4,7-8H2.
What are the key properties of benzylethoxysilane?
benzylethoxysilane has a molecular weight of 163.27 g/mol, XLogP of 1.72, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for benzylethoxysilane is sourced from PubChem (CID 66773279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).