triethyl-[(Z)-3-(4-phenylphenyl)hex-3-enoxy]silane

C24H34OSi — CID 162404763

IUPACtriethyl-[(Z)-3-(4-phenylphenyl)hex-3-enoxy]silane
SMILESCC/C=C(/CCO[Si](CC)(CC)CC)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C24H34OSi/c1-5-12-21(19-20-25-26(6-2,7-3)8-4)23-15-17-24(18-16-23)22-13-10-9-11-14-22/h9-18H,5-8,19-20H2,1-4H3/b21-12-
InChIKeyOCVXEYNHIOEIAN-MTJSOVHGSA-N
MW366.62 g/mol
LogP7.56
Rot. Bonds10

About triethyl-[(Z)-3-(4-phenylphenyl)hex-3-enoxy]silane

triethyl-[(Z)-3-(4-phenylphenyl)hex-3-enoxy]silane (PubChem CID 162404763) has the molecular formula C24H34OSi and a molecular weight of 366.62 g/mol. Its IUPAC name is triethyl-[(Z)-3-(4-phenylphenyl)hex-3-enoxy]silane.

Molecular Properties

Compound Nametriethyl-[(Z)-3-(4-phenylphenyl)hex-3-enoxy]silane
PubChem CID162404763
Molecular FormulaC24H34OSi
Molecular Weight366.62 g/mol
Exact Mass366.24
IUPAC Nametriethyl-[(Z)-3-(4-phenylphenyl)hex-3-enoxy]silane
SMILESCC/C=C(/CCO[Si](CC)(CC)CC)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C24H34OSi/c1-5-12-21(19-20-25-26(6-2,7-3)8-4)23-15-17-24(18-16-23)22-13-10-9-11-14-22/h9-18H,5-8,19-20H2,1-4H3/b21-12-
InChIKeyOCVXEYNHIOEIAN-MTJSOVHGSA-N
XLogP7.56
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.62
LogP ≤ 57.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of triethyl-[(Z)-3-(4-phenylphenyl)hex-3-enoxy]silane?
The IUPAC name of triethyl-[(Z)-3-(4-phenylphenyl)hex-3-enoxy]silane (CID 162404763) is triethyl-[(Z)-3-(4-phenylphenyl)hex-3-enoxy]silane.
What is the SMILES notation for triethyl-[(Z)-3-(4-phenylphenyl)hex-3-enoxy]silane?
The canonical SMILES for triethyl-[(Z)-3-(4-phenylphenyl)hex-3-enoxy]silane is CC/C=C(/CCO[Si](CC)(CC)CC)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of triethyl-[(Z)-3-(4-phenylphenyl)hex-3-enoxy]silane?
The InChIKey is OCVXEYNHIOEIAN-MTJSOVHGSA-N. The full InChI is InChI=1S/C24H34OSi/c1-5-12-21(19-20-25-26(6-2,7-3)8-4)23-15-17-24(18-16-23)22-13-10-9-11-14-22/h9-18H,5-8,19-20H2,1-4H3/b21-12-.
What are the key properties of triethyl-[(Z)-3-(4-phenylphenyl)hex-3-enoxy]silane?
triethyl-[(Z)-3-(4-phenylphenyl)hex-3-enoxy]silane has a molecular weight of 366.62 g/mol, XLogP of 7.56, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl-[(Z)-3-(4-phenylphenyl)hex-3-enoxy]silane is sourced from PubChem (CID 162404763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).