[bis[[2-[[dimethylsilyloxy(diphenyl)silyl]oxy-dimethylsilyl]ethyl-dimethylsilyl]oxy]-phenylsilyl]oxy-[1-[[dimethylsilyloxy(diphenyl)silyl]oxy-dimethylsilyl]ethenyl]-dimethylsilane

C66H102O9Si13 — CID 123363487

IUPAC[bis[[2-[[dimethylsilyloxy(diphenyl)silyl]oxy-dimethylsilyl]ethyl-dimethylsilyl]oxy]-phenylsilyl]oxy-[1-[[dimethylsilyloxy(diphenyl)silyl]oxy-dimethylsilyl]ethenyl]-dimethylsilane
SMILESC=C([Si](C)(C)O[Si](O[Si](C)(C)CC[Si](C)(C)O[Si](O[SiH](C)C)(c1ccccc1)c1ccccc1)(O[Si](C)(C)CC[Si](C)(C)O[Si](O[SiH](C)C)(c1ccccc1)c1ccccc1)c1ccccc1)[Si](C)(C)O[Si](O[SiH](C)C)(c1ccccc1)c1ccccc1
InChIInChI=1S/C66H102O9Si13/c1-59(83(16,17)74-87(69-78(6)7,64-49-35-24-36-50-64)65-51-37-25-38-52-65)84(18,19)75-88(66-53-39-26-40-54-66,72-81(12,13)57-55-79(8,9)70-85(67-76(2)3,60-41-27-20-28-42-60)61-43-29-21-30-44-61)73-82(14,15)58-56-80(10,11)71-86(68-77(4)5,62-45-31-22-32-46-62)63-47-33-23-34-48-63/h20-54,76-78H,1,55-58H2,2-19H3
InChIKeyAKIWBTOTNMURES-UHFFFAOYSA-N
MW1404.65 g/mol
LogP12.57
Rot. Bonds33

About [bis[[2-[[dimethylsilyloxy(diphenyl)silyl]oxy-dimethylsilyl]ethyl-dimethylsilyl]oxy]-phenylsilyl]oxy-[1-[[dimethylsilyloxy(diphenyl)silyl]oxy-dimethylsilyl]ethenyl]-dimethylsilane

[bis[[2-[[dimethylsilyloxy(diphenyl)silyl]oxy-dimethylsilyl]ethyl-dimethylsilyl]oxy]-phenylsilyl]oxy-[1-[[dimethylsilyloxy(diphenyl)silyl]oxy-dimethylsilyl]ethenyl]-dimethylsilane (PubChem CID 123363487) has the molecular formula C66H102O9Si13 and a molecular weight of 1404.65 g/mol. Its IUPAC name is [bis[[2-[[dimethylsilyloxy(diphenyl)silyl]oxy-dimethylsilyl]ethyl-dimethylsilyl]oxy]-phenylsilyl]oxy-[1-[[dimethylsilyloxy(diphenyl)silyl]oxy-dimethylsilyl]ethenyl]-dimethylsilane.

Molecular Properties

Compound Name[bis[[2-[[dimethylsilyloxy(diphenyl)silyl]oxy-dimethylsilyl]ethyl-dimethylsilyl]oxy]-phenylsilyl]oxy-[1-[[dimethylsilyloxy(diphenyl)silyl]oxy-dimethylsilyl]ethenyl]-dimethylsilane
PubChem CID123363487
Molecular FormulaC66H102O9Si13
Molecular Weight1404.65 g/mol
Exact Mass1402.45
IUPAC Name[bis[[2-[[dimethylsilyloxy(diphenyl)silyl]oxy-dimethylsilyl]ethyl-dimethylsilyl]oxy]-phenylsilyl]oxy-[1-[[dimethylsilyloxy(diphenyl)silyl]oxy-dimethylsilyl]ethenyl]-dimethylsilane
SMILESC=C([Si](C)(C)O[Si](O[Si](C)(C)CC[Si](C)(C)O[Si](O[SiH](C)C)(c1ccccc1)c1ccccc1)(O[Si](C)(C)CC[Si](C)(C)O[Si](O[SiH](C)C)(c1ccccc1)c1ccccc1)c1ccccc1)[Si](C)(C)O[Si](O[SiH](C)C)(c1ccccc1)c1ccccc1
InChIInChI=1S/C66H102O9Si13/c1-59(83(16,17)74-87(69-78(6)7,64-49-35-24-36-50-64)65-51-37-25-38-52-65)84(18,19)75-88(66-53-39-26-40-54-66,72-81(12,13)57-55-79(8,9)70-85(67-76(2)3,60-41-27-20-28-42-60)61-43-29-21-30-44-61)73-82(14,15)58-56-80(10,11)71-86(68-77(4)5,62-45-31-22-32-46-62)63-47-33-23-34-48-63/h20-54,76-78H,1,55-58H2,2-19H3
InChIKeyAKIWBTOTNMURES-UHFFFAOYSA-N
XLogP12.57
TPSA83.07 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds33
Heavy Atoms88
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001404.65
LogP ≤ 512.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

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

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of [bis[[2-[[dimethylsilyloxy(diphenyl)silyl]oxy-dimethylsilyl]ethyl-dimethylsilyl]oxy]-phenylsilyl]oxy-[1-[[dimethylsilyloxy(diphenyl)silyl]oxy-dimethylsilyl]ethenyl]-dimethylsilane?
The IUPAC name of [bis[[2-[[dimethylsilyloxy(diphenyl)silyl]oxy-dimethylsilyl]ethyl-dimethylsilyl]oxy]-phenylsilyl]oxy-[1-[[dimethylsilyloxy(diphenyl)silyl]oxy-dimethylsilyl]ethenyl]-dimethylsilane (CID 123363487) is [bis[[2-[[dimethylsilyloxy(diphenyl)silyl]oxy-dimethylsilyl]ethyl-dimethylsilyl]oxy]-phenylsilyl]oxy-[1-[[dimethylsilyloxy(diphenyl)silyl]oxy-dimethylsilyl]ethenyl]-dimethylsilane.
What is the SMILES notation for [bis[[2-[[dimethylsilyloxy(diphenyl)silyl]oxy-dimethylsilyl]ethyl-dimethylsilyl]oxy]-phenylsilyl]oxy-[1-[[dimethylsilyloxy(diphenyl)silyl]oxy-dimethylsilyl]ethenyl]-dimethylsilane?
The canonical SMILES for [bis[[2-[[dimethylsilyloxy(diphenyl)silyl]oxy-dimethylsilyl]ethyl-dimethylsilyl]oxy]-phenylsilyl]oxy-[1-[[dimethylsilyloxy(diphenyl)silyl]oxy-dimethylsilyl]ethenyl]-dimethylsilane is C=C([Si](C)(C)O[Si](O[Si](C)(C)CC[Si](C)(C)O[Si](O[SiH](C)C)(c1ccccc1)c1ccccc1)(O[Si](C)(C)CC[Si](C)(C)O[Si](O[SiH](C)C)(c1ccccc1)c1ccccc1)c1ccccc1)[Si](C)(C)O[Si](O[SiH](C)C)(c1ccccc1)c1ccccc1.
What is the InChIKey of [bis[[2-[[dimethylsilyloxy(diphenyl)silyl]oxy-dimethylsilyl]ethyl-dimethylsilyl]oxy]-phenylsilyl]oxy-[1-[[dimethylsilyloxy(diphenyl)silyl]oxy-dimethylsilyl]ethenyl]-dimethylsilane?
The InChIKey is AKIWBTOTNMURES-UHFFFAOYSA-N. The full InChI is InChI=1S/C66H102O9Si13/c1-59(83(16,17)74-87(69-78(6)7,64-49-35-24-36-50-64)65-51-37-25-38-52-65)84(18,19)75-88(66-53-39-26-40-54-66,72-81(12,13)57-55-79(8,9)70-85(67-76(2)3,60-41-27-20-28-42-60)61-43-29-21-30-44-61)73-82(14,15)58-56-80(10,11)71-86(68-77(4)5,62-45-31-22-32-46-62)63-47-33-23-34-48-63/h20-54,76-78H,1,55-58H2,2-19H3.
What are the key properties of [bis[[2-[[dimethylsilyloxy(diphenyl)silyl]oxy-dimethylsilyl]ethyl-dimethylsilyl]oxy]-phenylsilyl]oxy-[1-[[dimethylsilyloxy(diphenyl)silyl]oxy-dimethylsilyl]ethenyl]-dimethylsilane?
[bis[[2-[[dimethylsilyloxy(diphenyl)silyl]oxy-dimethylsilyl]ethyl-dimethylsilyl]oxy]-phenylsilyl]oxy-[1-[[dimethylsilyloxy(diphenyl)silyl]oxy-dimethylsilyl]ethenyl]-dimethylsilane has a molecular weight of 1404.65 g/mol, XLogP of 12.57, 33 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for [bis[[2-[[dimethylsilyloxy(diphenyl)silyl]oxy-dimethylsilyl]ethyl-dimethylsilyl]oxy]-phenylsilyl]oxy-[1-[[dimethylsilyloxy(diphenyl)silyl]oxy-dimethylsilyl]ethenyl]-dimethylsilane is sourced from PubChem (CID 123363487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).