(1-dimethylsilyl-2-phenylethenyl)-tris(trimethylsilyloxy)silane

C19H40O3Si5 — CID 175704291

IUPAC(1-dimethylsilyl-2-phenylethenyl)-tris(trimethylsilyloxy)silane
SMILESC[SiH](C)C(=Cc1ccccc1)[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C19H40O3Si5/c1-23(2)19(17-18-15-13-12-14-16-18)27(20-24(3,4)5,21-25(6,7)8)22-26(9,10)11/h12-17,23H,1-11H3
InChIKeyJHWOHBXBZNDEIB-UHFFFAOYSA-N
MW456.96 g/mol
LogP6.13
Rot. Bonds9

About (1-dimethylsilyl-2-phenylethenyl)-tris(trimethylsilyloxy)silane

(1-dimethylsilyl-2-phenylethenyl)-tris(trimethylsilyloxy)silane (PubChem CID 175704291) has the molecular formula C19H40O3Si5 and a molecular weight of 456.96 g/mol. Its IUPAC name is (1-dimethylsilyl-2-phenylethenyl)-tris(trimethylsilyloxy)silane.

Molecular Properties

Compound Name(1-dimethylsilyl-2-phenylethenyl)-tris(trimethylsilyloxy)silane
PubChem CID175704291
Molecular FormulaC19H40O3Si5
Molecular Weight456.96 g/mol
Exact Mass456.18
IUPAC Name(1-dimethylsilyl-2-phenylethenyl)-tris(trimethylsilyloxy)silane
SMILESC[SiH](C)C(=Cc1ccccc1)[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C19H40O3Si5/c1-23(2)19(17-18-15-13-12-14-16-18)27(20-24(3,4)5,21-25(6,7)8)22-26(9,10)11/h12-17,23H,1-11H3
InChIKeyJHWOHBXBZNDEIB-UHFFFAOYSA-N
XLogP6.13
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms27
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500456.96
LogP ≤ 56.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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 (1-dimethylsilyl-2-phenylethenyl)-tris(trimethylsilyloxy)silane?
The IUPAC name of (1-dimethylsilyl-2-phenylethenyl)-tris(trimethylsilyloxy)silane (CID 175704291) is (1-dimethylsilyl-2-phenylethenyl)-tris(trimethylsilyloxy)silane.
What is the SMILES notation for (1-dimethylsilyl-2-phenylethenyl)-tris(trimethylsilyloxy)silane?
The canonical SMILES for (1-dimethylsilyl-2-phenylethenyl)-tris(trimethylsilyloxy)silane is C[SiH](C)C(=Cc1ccccc1)[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)C.
What is the InChIKey of (1-dimethylsilyl-2-phenylethenyl)-tris(trimethylsilyloxy)silane?
The InChIKey is JHWOHBXBZNDEIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H40O3Si5/c1-23(2)19(17-18-15-13-12-14-16-18)27(20-24(3,4)5,21-25(6,7)8)22-26(9,10)11/h12-17,23H,1-11H3.
What are the key properties of (1-dimethylsilyl-2-phenylethenyl)-tris(trimethylsilyloxy)silane?
(1-dimethylsilyl-2-phenylethenyl)-tris(trimethylsilyloxy)silane has a molecular weight of 456.96 g/mol, XLogP of 6.13, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-dimethylsilyl-2-phenylethenyl)-tris(trimethylsilyloxy)silane is sourced from PubChem (CID 175704291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).