ethyl-dimethyl-(3-phenylpropoxy)silane

C13H22OSi — CID 576298

IUPACethyl-dimethyl-(3-phenylpropoxy)silane
SMILESCC[Si](C)(C)OCCCc1ccccc1
InChIInChI=1S/C13H22OSi/c1-4-15(2,3)14-12-8-11-13-9-6-5-7-10-13/h5-7,9-10H,4,8,11-12H2,1-3H3
InChIKeyHZSUOYOVCAOPBX-UHFFFAOYSA-N
MW222.40 g/mol
LogP3.86
Rot. Bonds6

About ethyl-dimethyl-(3-phenylpropoxy)silane

ethyl-dimethyl-(3-phenylpropoxy)silane (PubChem CID 576298) has the molecular formula C13H22OSi and a molecular weight of 222.40 g/mol. Its IUPAC name is ethyl-dimethyl-(3-phenylpropoxy)silane.

Molecular Properties

Compound Nameethyl-dimethyl-(3-phenylpropoxy)silane
PubChem CID576298
Molecular FormulaC13H22OSi
Molecular Weight222.40 g/mol
Exact Mass222.14
IUPAC Nameethyl-dimethyl-(3-phenylpropoxy)silane
SMILESCC[Si](C)(C)OCCCc1ccccc1
InChIInChI=1S/C13H22OSi/c1-4-15(2,3)14-12-8-11-13-9-6-5-7-10-13/h5-7,9-10H,4,8,11-12H2,1-3H3
InChIKeyHZSUOYOVCAOPBX-UHFFFAOYSA-N
XLogP3.86
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.40
LogP ≤ 53.86
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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Frequently Asked Questions

What is the IUPAC name of ethyl-dimethyl-(3-phenylpropoxy)silane?
The IUPAC name of ethyl-dimethyl-(3-phenylpropoxy)silane (CID 576298) is ethyl-dimethyl-(3-phenylpropoxy)silane.
What is the SMILES notation for ethyl-dimethyl-(3-phenylpropoxy)silane?
The canonical SMILES for ethyl-dimethyl-(3-phenylpropoxy)silane is CC[Si](C)(C)OCCCc1ccccc1.
What is the InChIKey of ethyl-dimethyl-(3-phenylpropoxy)silane?
The InChIKey is HZSUOYOVCAOPBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22OSi/c1-4-15(2,3)14-12-8-11-13-9-6-5-7-10-13/h5-7,9-10H,4,8,11-12H2,1-3H3.
What are the key properties of ethyl-dimethyl-(3-phenylpropoxy)silane?
ethyl-dimethyl-(3-phenylpropoxy)silane has a molecular weight of 222.40 g/mol, XLogP of 3.86, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl-dimethyl-(3-phenylpropoxy)silane is sourced from PubChem (CID 576298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).