phenyl(prop-2-enoxy)silane

C9H12OSi — CID 123615662

IUPACphenyl(prop-2-enoxy)silane
SMILESC=CCO[SiH2]c1ccccc1
InChIInChI=1S/C9H12OSi/c1-2-8-10-11-9-6-4-3-5-7-9/h2-7H,1,8,11H2
InChIKeyFJDAKQBKGIKLQK-UHFFFAOYSA-N
MW164.28 g/mol
LogP0.60
Rot. Bonds4

About phenyl(prop-2-enoxy)silane

phenyl(prop-2-enoxy)silane (PubChem CID 123615662) has the molecular formula C9H12OSi and a molecular weight of 164.28 g/mol. Its IUPAC name is phenyl(prop-2-enoxy)silane.

Molecular Properties

Compound Namephenyl(prop-2-enoxy)silane
PubChem CID123615662
Molecular FormulaC9H12OSi
Molecular Weight164.28 g/mol
Exact Mass164.07
IUPAC Namephenyl(prop-2-enoxy)silane
SMILESC=CCO[SiH2]c1ccccc1
InChIInChI=1S/C9H12OSi/c1-2-8-10-11-9-6-4-3-5-7-9/h2-7H,1,8,11H2
InChIKeyFJDAKQBKGIKLQK-UHFFFAOYSA-N
XLogP0.60
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.28
LogP ≤ 50.60
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': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of phenyl(prop-2-enoxy)silane?
The IUPAC name of phenyl(prop-2-enoxy)silane (CID 123615662) is phenyl(prop-2-enoxy)silane.
What is the SMILES notation for phenyl(prop-2-enoxy)silane?
The canonical SMILES for phenyl(prop-2-enoxy)silane is C=CCO[SiH2]c1ccccc1.
What is the InChIKey of phenyl(prop-2-enoxy)silane?
The InChIKey is FJDAKQBKGIKLQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12OSi/c1-2-8-10-11-9-6-4-3-5-7-9/h2-7H,1,8,11H2.
What are the key properties of phenyl(prop-2-enoxy)silane?
phenyl(prop-2-enoxy)silane has a molecular weight of 164.28 g/mol, XLogP of 0.60, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl(prop-2-enoxy)silane is sourced from PubChem (CID 123615662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).