[5-[dimethoxy(phenyl)silyl]-3,3-bis[2-[dimethoxy(phenyl)silyl]ethyl]pentyl]-dimethoxy-phenylsilane

C41H60O8Si4 — CID 69429750

IUPAC[5-[dimethoxy(phenyl)silyl]-3,3-bis[2-[dimethoxy(phenyl)silyl]ethyl]pentyl]-dimethoxy-phenylsilane
SMILESCO[Si](CCC(CC[Si](OC)(OC)c1ccccc1)(CC[Si](OC)(OC)c1ccccc1)CC[Si](OC)(OC)c1ccccc1)(OC)c1ccccc1
InChIInChI=1S/C41H60O8Si4/c1-42-50(43-2,37-21-13-9-14-22-37)33-29-41(30-34-51(44-3,45-4)38-23-15-10-16-24-38,31-35-52(46-5,47-6)39-25-17-11-18-26-39)32-36-53(48-7,49-8)40-27-19-12-20-28-40/h9-28H,29-36H2,1-8H3
InChIKeyRSMUMVNGJSMDRU-UHFFFAOYSA-N
MW793.27 g/mol
LogP6.10
Rot. Bonds24

About [5-[dimethoxy(phenyl)silyl]-3,3-bis[2-[dimethoxy(phenyl)silyl]ethyl]pentyl]-dimethoxy-phenylsilane

[5-[dimethoxy(phenyl)silyl]-3,3-bis[2-[dimethoxy(phenyl)silyl]ethyl]pentyl]-dimethoxy-phenylsilane (PubChem CID 69429750) has the molecular formula C41H60O8Si4 and a molecular weight of 793.27 g/mol. Its IUPAC name is [5-[dimethoxy(phenyl)silyl]-3,3-bis[2-[dimethoxy(phenyl)silyl]ethyl]pentyl]-dimethoxy-phenylsilane.

Molecular Properties

Compound Name[5-[dimethoxy(phenyl)silyl]-3,3-bis[2-[dimethoxy(phenyl)silyl]ethyl]pentyl]-dimethoxy-phenylsilane
PubChem CID69429750
Molecular FormulaC41H60O8Si4
Molecular Weight793.27 g/mol
Exact Mass792.34
IUPAC Name[5-[dimethoxy(phenyl)silyl]-3,3-bis[2-[dimethoxy(phenyl)silyl]ethyl]pentyl]-dimethoxy-phenylsilane
SMILESCO[Si](CCC(CC[Si](OC)(OC)c1ccccc1)(CC[Si](OC)(OC)c1ccccc1)CC[Si](OC)(OC)c1ccccc1)(OC)c1ccccc1
InChIInChI=1S/C41H60O8Si4/c1-42-50(43-2,37-21-13-9-14-22-37)33-29-41(30-34-51(44-3,45-4)38-23-15-10-16-24-38,31-35-52(46-5,47-6)39-25-17-11-18-26-39)32-36-53(48-7,49-8)40-27-19-12-20-28-40/h9-28H,29-36H2,1-8H3
InChIKeyRSMUMVNGJSMDRU-UHFFFAOYSA-N
XLogP6.10
TPSA73.84 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds24
Heavy Atoms53
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500793.27
LogP ≤ 56.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

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Related Compounds

[11-[dimethoxy(phenyl)silyl]-6,6-bis[5-[dimethoxy(phenyl)silyl]pentyl]undecyl]-dimethoxy-phenylsilane
CID 87833172
dimethoxy-phenyl-(2-trimethylsilylethyl)silane
CID 59357473
butyl-dimethoxy-phenylsilane
CID 66773516
bromomethyl-dimethoxy-phenylsilane
CID 66970118
(3-bromo-2-methylpropyl)-dimethoxy-phenylsilane
CID 54198141
methoxy-phenyl-phenylmethoxy-propylsilane
CID 174912796
dimethoxy-phenyl-[3-(1,2,4-triazol-1-yl)propyl]silane
CID 59630466
trimethoxy(phenyl)silane;hydrochloride
CID 140901295
chloromethyl-methoxy-diphenylsilane
CID 66969961
2-[dimethyl(triphenylsilyloxy)silyl]ethyl-dimethyl-triphenylsilyloxysilane
CID 140828433
[3,5-bis[[dimethoxy(phenyl)silyl]methyl]-2-methylphenyl]methyl-dimethoxy-phenylsilane
CID 90761727
[6-[dimethoxy(phenyl)silyl]-4-[2-[dimethoxy(phenyl)silyl]propyl]heptan-2-yl]-dimethoxy-phenylsilane
CID 69434547

Frequently Asked Questions

What is the IUPAC name of [5-[dimethoxy(phenyl)silyl]-3,3-bis[2-[dimethoxy(phenyl)silyl]ethyl]pentyl]-dimethoxy-phenylsilane?
The IUPAC name of [5-[dimethoxy(phenyl)silyl]-3,3-bis[2-[dimethoxy(phenyl)silyl]ethyl]pentyl]-dimethoxy-phenylsilane (CID 69429750) is [5-[dimethoxy(phenyl)silyl]-3,3-bis[2-[dimethoxy(phenyl)silyl]ethyl]pentyl]-dimethoxy-phenylsilane.
What is the SMILES notation for [5-[dimethoxy(phenyl)silyl]-3,3-bis[2-[dimethoxy(phenyl)silyl]ethyl]pentyl]-dimethoxy-phenylsilane?
The canonical SMILES for [5-[dimethoxy(phenyl)silyl]-3,3-bis[2-[dimethoxy(phenyl)silyl]ethyl]pentyl]-dimethoxy-phenylsilane is CO[Si](CCC(CC[Si](OC)(OC)c1ccccc1)(CC[Si](OC)(OC)c1ccccc1)CC[Si](OC)(OC)c1ccccc1)(OC)c1ccccc1.
What is the InChIKey of [5-[dimethoxy(phenyl)silyl]-3,3-bis[2-[dimethoxy(phenyl)silyl]ethyl]pentyl]-dimethoxy-phenylsilane?
The InChIKey is RSMUMVNGJSMDRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C41H60O8Si4/c1-42-50(43-2,37-21-13-9-14-22-37)33-29-41(30-34-51(44-3,45-4)38-23-15-10-16-24-38,31-35-52(46-5,47-6)39-25-17-11-18-26-39)32-36-53(48-7,49-8)40-27-19-12-20-28-40/h9-28H,29-36H2,1-8H3.
What are the key properties of [5-[dimethoxy(phenyl)silyl]-3,3-bis[2-[dimethoxy(phenyl)silyl]ethyl]pentyl]-dimethoxy-phenylsilane?
[5-[dimethoxy(phenyl)silyl]-3,3-bis[2-[dimethoxy(phenyl)silyl]ethyl]pentyl]-dimethoxy-phenylsilane has a molecular weight of 793.27 g/mol, XLogP of 6.10, 24 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[dimethoxy(phenyl)silyl]-3,3-bis[2-[dimethoxy(phenyl)silyl]ethyl]pentyl]-dimethoxy-phenylsilane is sourced from PubChem (CID 69429750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).