(4-methoxyphenyl)-dimethyl-(3,4,5-trimethoxyphenyl)silane

C18H24O4Si — CID 72697351

IUPAC(4-methoxyphenyl)-dimethyl-(3,4,5-trimethoxyphenyl)silane
SMILESCOc1ccc([Si](C)(C)c2cc(OC)c(OC)c(OC)c2)cc1
InChIInChI=1S/C18H24O4Si/c1-19-13-7-9-14(10-8-13)23(5,6)15-11-16(20-2)18(22-4)17(12-15)21-3/h7-12H,1-6H3
InChIKeyBEHUPMUBXGUXNZ-UHFFFAOYSA-N
MW332.47 g/mol
LogP2.54
Rot. Bonds6

About (4-methoxyphenyl)-dimethyl-(3,4,5-trimethoxyphenyl)silane

(4-methoxyphenyl)-dimethyl-(3,4,5-trimethoxyphenyl)silane (PubChem CID 72697351) has the molecular formula C18H24O4Si and a molecular weight of 332.47 g/mol. Its IUPAC name is (4-methoxyphenyl)-dimethyl-(3,4,5-trimethoxyphenyl)silane.

Molecular Properties

Compound Name(4-methoxyphenyl)-dimethyl-(3,4,5-trimethoxyphenyl)silane
PubChem CID72697351
Molecular FormulaC18H24O4Si
Molecular Weight332.47 g/mol
Exact Mass332.14
IUPAC Name(4-methoxyphenyl)-dimethyl-(3,4,5-trimethoxyphenyl)silane
SMILESCOc1ccc([Si](C)(C)c2cc(OC)c(OC)c(OC)c2)cc1
InChIInChI=1S/C18H24O4Si/c1-19-13-7-9-14(10-8-13)23(5,6)15-11-16(20-2)18(22-4)17(12-15)21-3/h7-12H,1-6H3
InChIKeyBEHUPMUBXGUXNZ-UHFFFAOYSA-N
XLogP2.54
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.47
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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 (4-methoxyphenyl)-dimethyl-(3,4,5-trimethoxyphenyl)silane?
The IUPAC name of (4-methoxyphenyl)-dimethyl-(3,4,5-trimethoxyphenyl)silane (CID 72697351) is (4-methoxyphenyl)-dimethyl-(3,4,5-trimethoxyphenyl)silane.
What is the SMILES notation for (4-methoxyphenyl)-dimethyl-(3,4,5-trimethoxyphenyl)silane?
The canonical SMILES for (4-methoxyphenyl)-dimethyl-(3,4,5-trimethoxyphenyl)silane is COc1ccc([Si](C)(C)c2cc(OC)c(OC)c(OC)c2)cc1.
What is the InChIKey of (4-methoxyphenyl)-dimethyl-(3,4,5-trimethoxyphenyl)silane?
The InChIKey is BEHUPMUBXGUXNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24O4Si/c1-19-13-7-9-14(10-8-13)23(5,6)15-11-16(20-2)18(22-4)17(12-15)21-3/h7-12H,1-6H3.
What are the key properties of (4-methoxyphenyl)-dimethyl-(3,4,5-trimethoxyphenyl)silane?
(4-methoxyphenyl)-dimethyl-(3,4,5-trimethoxyphenyl)silane has a molecular weight of 332.47 g/mol, XLogP of 2.54, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methoxyphenyl)-dimethyl-(3,4,5-trimethoxyphenyl)silane is sourced from PubChem (CID 72697351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).