[[[bis[[methyl(diphenyl)silyl]oxy]-triphenylsilyloxysilyl]methyl-dimethylsilyl]oxy-[2-[[dimethyl(phenyl)silyl]oxy-bis(trimethylsilyloxy)silyl]ethyl-dimethylsilyl]oxy-[dimethyl-[2-tris(triphenylsilyloxy)silylethyl]silyl]oxysilyl]methyl 2,2-dimethylbutanoate

C130H156O14Si16 — CID 88568238

IUPAC[[[bis[[methyl(diphenyl)silyl]oxy]-triphenylsilyloxysilyl]methyl-dimethylsilyl]oxy-[2-[[dimethyl(phenyl)silyl]oxy-bis(trimethylsilyloxy)silyl]ethyl-dimethylsilyl]oxy-[dimethyl-[2-tris(triphenylsilyloxy)silylethyl]silyl]oxysilyl]methyl 2,2-dimethylbutanoate
SMILESCCC(C)(C)C(=O)OC[Si](O[Si](C)(C)CC[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)c1ccccc1)(O[Si](C)(C)CC[Si](O[Si](c1ccccc1)(c1ccccc1)c1ccccc1)(O[Si](c1ccccc1)(c1ccccc1)c1ccccc1)O[Si](c1ccccc1)(c1ccccc1)c1ccccc1)O[Si](C)(C)C[Si](O[Si](C)(c1ccccc1)c1ccccc1)(O[Si](C)(c1ccccc1)c1ccccc1)O[Si](c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C130H156O14Si16/c1-20-130(2,3)129(131)132-110-155(135-147(10,11)106-108-153(133-145(4,5)6,134-146(7,8)9)138-150(16,17)112-72-38-21-39-73-112,137-149(14,15)111-156(139-151(18,113-74-40-22-41-75-113)114-76-42-23-43-77-114,140-152(19,115-78-44-24-45-79-115)116-80-46-25-47-81-116)144-160(126-100-66-35-67-101-126,127-102-68-36-69-103-127)128-104-70-37-71-105-128)136-148(12,13)107-109-154(141-157(117-82-48-26-49-83-117,118-84-50-27-51-85-118)119-86-52-28-53-87-119,142-158(120-88-54-29-55-89-120,121-90-56-30-57-91-121)122-92-58-31-59-93-122)143-159(123-94-60-32-61-95-123,124-96-62-33-63-97-124)125-98-64-34-65-99-125/h21-105H,20,106-111H2,1-19H3
InChIKeyKIENQCUDTCINQY-UHFFFAOYSA-N
MW2392.04 g/mol
LogP20.84
Rot. Bonds53

About [[[bis[[methyl(diphenyl)silyl]oxy]-triphenylsilyloxysilyl]methyl-dimethylsilyl]oxy-[2-[[dimethyl(phenyl)silyl]oxy-bis(trimethylsilyloxy)silyl]ethyl-dimethylsilyl]oxy-[dimethyl-[2-tris(triphenylsilyloxy)silylethyl]silyl]oxysilyl]methyl 2,2-dimethylbutanoate

[[[bis[[methyl(diphenyl)silyl]oxy]-triphenylsilyloxysilyl]methyl-dimethylsilyl]oxy-[2-[[dimethyl(phenyl)silyl]oxy-bis(trimethylsilyloxy)silyl]ethyl-dimethylsilyl]oxy-[dimethyl-[2-tris(triphenylsilyloxy)silylethyl]silyl]oxysilyl]methyl 2,2-dimethylbutanoate (PubChem CID 88568238) has the molecular formula C130H156O14Si16 and a molecular weight of 2392.04 g/mol. Its IUPAC name is [[[bis[[methyl(diphenyl)silyl]oxy]-triphenylsilyloxysilyl]methyl-dimethylsilyl]oxy-[2-[[dimethyl(phenyl)silyl]oxy-bis(trimethylsilyloxy)silyl]ethyl-dimethylsilyl]oxy-[dimethyl-[2-tris(triphenylsilyloxy)silylethyl]silyl]oxysilyl]methyl 2,2-dimethylbutanoate.

Molecular Properties

Compound Name[[[bis[[methyl(diphenyl)silyl]oxy]-triphenylsilyloxysilyl]methyl-dimethylsilyl]oxy-[2-[[dimethyl(phenyl)silyl]oxy-bis(trimethylsilyloxy)silyl]ethyl-dimethylsilyl]oxy-[dimethyl-[2-tris(triphenylsilyloxy)silylethyl]silyl]oxysilyl]methyl 2,2-dimethylbutanoate
PubChem CID88568238
Molecular FormulaC130H156O14Si16
Molecular Weight2392.04 g/mol
Exact Mass2388.78
IUPAC Name[[[bis[[methyl(diphenyl)silyl]oxy]-triphenylsilyloxysilyl]methyl-dimethylsilyl]oxy-[2-[[dimethyl(phenyl)silyl]oxy-bis(trimethylsilyloxy)silyl]ethyl-dimethylsilyl]oxy-[dimethyl-[2-tris(triphenylsilyloxy)silylethyl]silyl]oxysilyl]methyl 2,2-dimethylbutanoate
SMILESCCC(C)(C)C(=O)OC[Si](O[Si](C)(C)CC[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)c1ccccc1)(O[Si](C)(C)CC[Si](O[Si](c1ccccc1)(c1ccccc1)c1ccccc1)(O[Si](c1ccccc1)(c1ccccc1)c1ccccc1)O[Si](c1ccccc1)(c1ccccc1)c1ccccc1)O[Si](C)(C)C[Si](O[Si](C)(c1ccccc1)c1ccccc1)(O[Si](C)(c1ccccc1)c1ccccc1)O[Si](c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C130H156O14Si16/c1-20-130(2,3)129(131)132-110-155(135-147(10,11)106-108-153(133-145(4,5)6,134-146(7,8)9)138-150(16,17)112-72-38-21-39-73-112,137-149(14,15)111-156(139-151(18,113-74-40-22-41-75-113)114-76-42-23-43-77-114,140-152(19,115-78-44-24-45-79-115)116-80-46-25-47-81-116)144-160(126-100-66-35-67-101-126,127-102-68-36-69-103-127)128-104-70-37-71-105-128)136-148(12,13)107-109-154(141-157(117-82-48-26-49-83-117,118-84-50-27-51-85-118)119-86-52-28-53-87-119,142-158(120-88-54-29-55-89-120,121-90-56-30-57-91-121)122-92-58-31-59-93-122)143-159(123-94-60-32-61-95-123,124-96-62-33-63-97-124)125-98-64-34-65-99-125/h21-105H,20,106-111H2,1-19H3
InChIKeyKIENQCUDTCINQY-UHFFFAOYSA-N
XLogP20.84
TPSA137.06 Ų
H-Bond Donors
H-Bond Acceptors14
Rotatable Bonds53
Heavy Atoms160
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002392.04
LogP ≤ 520.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1014

Computed Properties (RDKit)

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

Analyze [[[bis[[methyl(diphenyl)silyl]oxy]-triphenylsilyloxysilyl]methyl-dimethylsilyl]oxy-[2-[[dimethyl(phenyl)silyl]oxy-bis(trimethylsilyloxy)silyl]ethyl-dimethylsilyl]oxy-[dimethyl-[2-tris(triphenylsilyloxy)silylethyl]silyl]oxysilyl]methyl 2,2-dimethylbutanoate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [[[bis[[methyl(diphenyl)silyl]oxy]-triphenylsilyloxysilyl]methyl-dimethylsilyl]oxy-[2-[[dimethyl(phenyl)silyl]oxy-bis(trimethylsilyloxy)silyl]ethyl-dimethylsilyl]oxy-[dimethyl-[2-tris(triphenylsilyloxy)silylethyl]silyl]oxysilyl]methyl 2,2-dimethylbutanoate?
The IUPAC name of [[[bis[[methyl(diphenyl)silyl]oxy]-triphenylsilyloxysilyl]methyl-dimethylsilyl]oxy-[2-[[dimethyl(phenyl)silyl]oxy-bis(trimethylsilyloxy)silyl]ethyl-dimethylsilyl]oxy-[dimethyl-[2-tris(triphenylsilyloxy)silylethyl]silyl]oxysilyl]methyl 2,2-dimethylbutanoate (CID 88568238) is [[[bis[[methyl(diphenyl)silyl]oxy]-triphenylsilyloxysilyl]methyl-dimethylsilyl]oxy-[2-[[dimethyl(phenyl)silyl]oxy-bis(trimethylsilyloxy)silyl]ethyl-dimethylsilyl]oxy-[dimethyl-[2-tris(triphenylsilyloxy)silylethyl]silyl]oxysilyl]methyl 2,2-dimethylbutanoate.
What is the SMILES notation for [[[bis[[methyl(diphenyl)silyl]oxy]-triphenylsilyloxysilyl]methyl-dimethylsilyl]oxy-[2-[[dimethyl(phenyl)silyl]oxy-bis(trimethylsilyloxy)silyl]ethyl-dimethylsilyl]oxy-[dimethyl-[2-tris(triphenylsilyloxy)silylethyl]silyl]oxysilyl]methyl 2,2-dimethylbutanoate?
The canonical SMILES for [[[bis[[methyl(diphenyl)silyl]oxy]-triphenylsilyloxysilyl]methyl-dimethylsilyl]oxy-[2-[[dimethyl(phenyl)silyl]oxy-bis(trimethylsilyloxy)silyl]ethyl-dimethylsilyl]oxy-[dimethyl-[2-tris(triphenylsilyloxy)silylethyl]silyl]oxysilyl]methyl 2,2-dimethylbutanoate is CCC(C)(C)C(=O)OC[Si](O[Si](C)(C)CC[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)c1ccccc1)(O[Si](C)(C)CC[Si](O[Si](c1ccccc1)(c1ccccc1)c1ccccc1)(O[Si](c1ccccc1)(c1ccccc1)c1ccccc1)O[Si](c1ccccc1)(c1ccccc1)c1ccccc1)O[Si](C)(C)C[Si](O[Si](C)(c1ccccc1)c1ccccc1)(O[Si](C)(c1ccccc1)c1ccccc1)O[Si](c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of [[[bis[[methyl(diphenyl)silyl]oxy]-triphenylsilyloxysilyl]methyl-dimethylsilyl]oxy-[2-[[dimethyl(phenyl)silyl]oxy-bis(trimethylsilyloxy)silyl]ethyl-dimethylsilyl]oxy-[dimethyl-[2-tris(triphenylsilyloxy)silylethyl]silyl]oxysilyl]methyl 2,2-dimethylbutanoate?
The InChIKey is KIENQCUDTCINQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C130H156O14Si16/c1-20-130(2,3)129(131)132-110-155(135-147(10,11)106-108-153(133-145(4,5)6,134-146(7,8)9)138-150(16,17)112-72-38-21-39-73-112,137-149(14,15)111-156(139-151(18,113-74-40-22-41-75-113)114-76-42-23-43-77-114,140-152(19,115-78-44-24-45-79-115)116-80-46-25-47-81-116)144-160(126-100-66-35-67-101-126,127-102-68-36-69-103-127)128-104-70-37-71-105-128)136-148(12,13)107-109-154(141-157(117-82-48-26-49-83-117,118-84-50-27-51-85-118)119-86-52-28-53-87-119,142-158(120-88-54-29-55-89-120,121-90-56-30-57-91-121)122-92-58-31-59-93-122)143-159(123-94-60-32-61-95-123,124-96-62-33-63-97-124)125-98-64-34-65-99-125/h21-105H,20,106-111H2,1-19H3.
What are the key properties of [[[bis[[methyl(diphenyl)silyl]oxy]-triphenylsilyloxysilyl]methyl-dimethylsilyl]oxy-[2-[[dimethyl(phenyl)silyl]oxy-bis(trimethylsilyloxy)silyl]ethyl-dimethylsilyl]oxy-[dimethyl-[2-tris(triphenylsilyloxy)silylethyl]silyl]oxysilyl]methyl 2,2-dimethylbutanoate?
[[[bis[[methyl(diphenyl)silyl]oxy]-triphenylsilyloxysilyl]methyl-dimethylsilyl]oxy-[2-[[dimethyl(phenyl)silyl]oxy-bis(trimethylsilyloxy)silyl]ethyl-dimethylsilyl]oxy-[dimethyl-[2-tris(triphenylsilyloxy)silylethyl]silyl]oxysilyl]methyl 2,2-dimethylbutanoate has a molecular weight of 2392.04 g/mol, XLogP of 20.84, 53 rotatable bonds, 0 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for [[[bis[[methyl(diphenyl)silyl]oxy]-triphenylsilyloxysilyl]methyl-dimethylsilyl]oxy-[2-[[dimethyl(phenyl)silyl]oxy-bis(trimethylsilyloxy)silyl]ethyl-dimethylsilyl]oxy-[dimethyl-[2-tris(triphenylsilyloxy)silylethyl]silyl]oxysilyl]methyl 2,2-dimethylbutanoate is sourced from PubChem (CID 88568238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).