methyl-[(1S,2S)-2-[methyl(diphenyl)silyl]oxy-1,2-diphenylethoxy]-diphenylsilane

C40H38O2Si2 — CID 102172480

IUPACmethyl-[(1S,2S)-2-[methyl(diphenyl)silyl]oxy-1,2-diphenylethoxy]-diphenylsilane
SMILESC[Si](O[C@@H](c1ccccc1)[C@@H](O[Si](C)(c1ccccc1)c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C40H38O2Si2/c1-43(35-25-13-5-14-26-35,36-27-15-6-16-28-36)41-39(33-21-9-3-10-22-33)40(34-23-11-4-12-24-34)42-44(2,37-29-17-7-18-30-37)38-31-19-8-20-32-38/h3-32,39-40H,1-2H3/t39-,40-/m0/s1
InChIKeyAYWGVMFAFAIFHB-ZAQUEYBZSA-N
MW606.91 g/mol
LogP7.28
Rot. Bonds11

About methyl-[(1S,2S)-2-[methyl(diphenyl)silyl]oxy-1,2-diphenylethoxy]-diphenylsilane

methyl-[(1S,2S)-2-[methyl(diphenyl)silyl]oxy-1,2-diphenylethoxy]-diphenylsilane (PubChem CID 102172480) has the molecular formula C40H38O2Si2 and a molecular weight of 606.91 g/mol. Its IUPAC name is methyl-[(1S,2S)-2-[methyl(diphenyl)silyl]oxy-1,2-diphenylethoxy]-diphenylsilane.

Molecular Properties

Compound Namemethyl-[(1S,2S)-2-[methyl(diphenyl)silyl]oxy-1,2-diphenylethoxy]-diphenylsilane
PubChem CID102172480
Molecular FormulaC40H38O2Si2
Molecular Weight606.91 g/mol
Exact Mass606.24
IUPAC Namemethyl-[(1S,2S)-2-[methyl(diphenyl)silyl]oxy-1,2-diphenylethoxy]-diphenylsilane
SMILESC[Si](O[C@@H](c1ccccc1)[C@@H](O[Si](C)(c1ccccc1)c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C40H38O2Si2/c1-43(35-25-13-5-14-26-35,36-27-15-6-16-28-36)41-39(33-21-9-3-10-22-33)40(34-23-11-4-12-24-34)42-44(2,37-29-17-7-18-30-37)38-31-19-8-20-32-38/h3-32,39-40H,1-2H3/t39-,40-/m0/s1
InChIKeyAYWGVMFAFAIFHB-ZAQUEYBZSA-N
XLogP7.28
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms44
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500606.91
LogP ≤ 57.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

[(1S,2S)-1,2-bis(4-bromophenyl)-2-[methyl(diphenyl)silyl]oxyethoxy]-methyl-diphenylsilane
CID 102172487
tert-butyl-[(1R,2R)-2-[tert-butyl(diphenyl)silyl]oxy-1,2-diphenylethoxy]-diphenylsilane
CID 11028852
trimethyl(1-phenylethoxy)silane
CID 519015
[(1R)-2,2-dimethyl-1-phenylpropoxy]-trimethylsilane
CID 101471174
trimethyl-(2,2,2-trifluoro-1-phenylethoxy)silane
CID 11218868
(1S,2S)-N-methyl-1-phenyl-N-trimethylsilyl-1-trimethylsilyloxypropan-2-amine
CID 102239963
bis[[methyl(diphenyl)silyl]oxy]-diphenylsilane
CID 19905828
diphenyl-bis(1-phenylethoxy)silane
CID 68535172
CID 22638459
CID 22638459
methyl-phenyl-di(propan-2-yloxy)silane
CID 15206336
methyl-(methyl-phenyl-propan-2-yloxysilyl)-phenyl-propan-2-yloxysilane
CID 102481335
trimethyl-[1-phenoxy-3-(3-phenoxy-3-phenyl-2-trimethylsilyloxypropoxy)-1-phenylpropan-2-yl]oxysilane
CID 139719240

Frequently Asked Questions

What is the IUPAC name of methyl-[(1S,2S)-2-[methyl(diphenyl)silyl]oxy-1,2-diphenylethoxy]-diphenylsilane?
The IUPAC name of methyl-[(1S,2S)-2-[methyl(diphenyl)silyl]oxy-1,2-diphenylethoxy]-diphenylsilane (CID 102172480) is methyl-[(1S,2S)-2-[methyl(diphenyl)silyl]oxy-1,2-diphenylethoxy]-diphenylsilane.
What is the SMILES notation for methyl-[(1S,2S)-2-[methyl(diphenyl)silyl]oxy-1,2-diphenylethoxy]-diphenylsilane?
The canonical SMILES for methyl-[(1S,2S)-2-[methyl(diphenyl)silyl]oxy-1,2-diphenylethoxy]-diphenylsilane is C[Si](O[C@@H](c1ccccc1)[C@@H](O[Si](C)(c1ccccc1)c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of methyl-[(1S,2S)-2-[methyl(diphenyl)silyl]oxy-1,2-diphenylethoxy]-diphenylsilane?
The InChIKey is AYWGVMFAFAIFHB-ZAQUEYBZSA-N. The full InChI is InChI=1S/C40H38O2Si2/c1-43(35-25-13-5-14-26-35,36-27-15-6-16-28-36)41-39(33-21-9-3-10-22-33)40(34-23-11-4-12-24-34)42-44(2,37-29-17-7-18-30-37)38-31-19-8-20-32-38/h3-32,39-40H,1-2H3/t39-,40-/m0/s1.
What are the key properties of methyl-[(1S,2S)-2-[methyl(diphenyl)silyl]oxy-1,2-diphenylethoxy]-diphenylsilane?
methyl-[(1S,2S)-2-[methyl(diphenyl)silyl]oxy-1,2-diphenylethoxy]-diphenylsilane has a molecular weight of 606.91 g/mol, XLogP of 7.28, 11 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methyl-[(1S,2S)-2-[methyl(diphenyl)silyl]oxy-1,2-diphenylethoxy]-diphenylsilane is sourced from PubChem (CID 102172480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).