CID 90340316

C36H43O4Si5 — CID 90340316

IUPAC—
SMILESC[Si](C)O[Si](C)(C)O[Si](C)(C)O[Si](O[Si](c1ccccc1)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C36H43O4Si5/c1-41(2)37-42(3,4)38-43(5,6)39-45(35-28-18-10-19-29-35,36-30-20-11-21-31-36)40-44(32-22-12-7-13-23-32,33-24-14-8-15-25-33)34-26-16-9-17-27-34/h7-31H,1-6H3
InChIKeyDKRVMEFRNCPGEK-UHFFFAOYSA-N
MW680.17 g/mol
LogP5.63
Rot. Bonds13

About CID 90340316

CID 90340316 (PubChem CID 90340316) has the molecular formula C36H43O4Si5 and a molecular weight of 680.17 g/mol.

Molecular Properties

Compound NameCID 90340316
PubChem CID90340316
Molecular FormulaC36H43O4Si5
Molecular Weight680.17 g/mol
Exact Mass679.20
IUPAC Name—
SMILESC[Si](C)O[Si](C)(C)O[Si](C)(C)O[Si](O[Si](c1ccccc1)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C36H43O4Si5/c1-41(2)37-42(3,4)38-43(5,6)39-45(35-28-18-10-19-29-35,36-30-20-11-21-31-36)40-44(32-22-12-7-13-23-32,33-24-14-8-15-25-33)34-26-16-9-17-27-34/h7-31H,1-6H3
InChIKeyDKRVMEFRNCPGEK-UHFFFAOYSA-N
XLogP5.63
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds13
Heavy Atoms45
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500680.17
LogP ≤ 55.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

[diphenyl(triphenylsilyloxy)silyl]oxy-[[[[[[diphenyl(triphenylsilyloxy)silyl]oxy-diphenylsilyl]oxy-diphenylsilyl]oxy-diphenylsilyl]oxy-diphenylsilyl]oxy-diphenylsilyl]oxy-diphenylsilane
CID 139707283
[dimethyl(trimethylsilyloxy)silyl]oxy-diphenyl-trimethylsilyloxysilane;methane;molecular fluorine
CID 163412390
[dimethyl(trimethylsilyloxy)silyl]oxy-diphenyl-trimethylsilyloxysilane;molecular fluorine;hydrofluoride
CID 165049411
[dimethyl(trimethylsilyloxy)silyl]oxy-diphenyl-trimethylsilyloxysilane;methane;molecular fluorine;hydrofluoride
CID 163992671
CID 59593737
CID 59593737
bis[[hydroxy(dimethyl)silyl]oxy]-dimethylsilane;bis[[hydroxy(dimethyl)silyl]oxy]-diphenylsilane;methane
CID 161380032
[diphenyl(triphenylsilyloxy)silyl]oxy-[hydroxy(diphenyl)silyl]oxy-diphenylsilane
CID 18323248
bis[[methyl(diphenyl)silyl]oxy]-diphenylsilane
CID 19905828
ethenyl-[[(ethenyl-methyl-phenylsilyl)oxy-dimethylsilyl]oxy-diphenylsilyl]oxy-methyl-phenylsilane
CID 58556684
[diphenyl(triphenylsilyloxy)silyl]oxy-methoxy-[[methoxy(diphenyl)silyl]oxy-diphenylsilyl]oxy-phenylsilane
CID 140689464
bis[[hydroxy(dimethyl)silyl]oxy]-dimethylsilane;bis[[hydroxy(diphenyl)silyl]oxy]-diphenylsilane;hydroxy-[[[hydroxy(diphenyl)silyl]oxy-dimethylsilyl]oxy-diphenylsilyl]oxy-diphenylsilane
CID 159001259
CID 136823520
CID 136823520

Frequently Asked Questions

What is the IUPAC name of CID 90340316?
The IUPAC name of CID 90340316 (CID 90340316) is not available.
What is the SMILES notation for CID 90340316?
The canonical SMILES for CID 90340316 is C[Si](C)O[Si](C)(C)O[Si](C)(C)O[Si](O[Si](c1ccccc1)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of CID 90340316?
The InChIKey is DKRVMEFRNCPGEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H43O4Si5/c1-41(2)37-42(3,4)38-43(5,6)39-45(35-28-18-10-19-29-35,36-30-20-11-21-31-36)40-44(32-22-12-7-13-23-32,33-24-14-8-15-25-33)34-26-16-9-17-27-34/h7-31H,1-6H3.
What are the key properties of CID 90340316?
CID 90340316 has a molecular weight of 680.17 g/mol, XLogP of 5.63, 13 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 90340316 is sourced from PubChem (CID 90340316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).