3,3-bis(9H-fluoren-9-yl)pentoxy-trimethylsilane

C34H36OSi — CID 18622633

IUPAC3,3-bis(9H-fluoren-9-yl)pentoxy-trimethylsilane
SMILESCCC(CCO[Si](C)(C)C)(C1c2ccccc2-c2ccccc21)C1c2ccccc2-c2ccccc21
InChIInChI=1S/C34H36OSi/c1-5-34(22-23-35-36(2,3)4,32-28-18-10-6-14-24(28)25-15-7-11-19-29(25)32)33-30-20-12-8-16-26(30)27-17-9-13-21-31(27)33/h6-21,32-33H,5,22-23H2,1-4H3
InChIKeyNHSQVBBKHNIACC-UHFFFAOYSA-N
MW488.75 g/mol
LogP9.25
Rot. Bonds7

About 3,3-bis(9H-fluoren-9-yl)pentoxy-trimethylsilane

3,3-bis(9H-fluoren-9-yl)pentoxy-trimethylsilane (PubChem CID 18622633) has the molecular formula C34H36OSi and a molecular weight of 488.75 g/mol. Its IUPAC name is 3,3-bis(9H-fluoren-9-yl)pentoxy-trimethylsilane.

Molecular Properties

Compound Name3,3-bis(9H-fluoren-9-yl)pentoxy-trimethylsilane
PubChem CID18622633
Molecular FormulaC34H36OSi
Molecular Weight488.75 g/mol
Exact Mass488.25
IUPAC Name3,3-bis(9H-fluoren-9-yl)pentoxy-trimethylsilane
SMILESCCC(CCO[Si](C)(C)C)(C1c2ccccc2-c2ccccc21)C1c2ccccc2-c2ccccc21
InChIInChI=1S/C34H36OSi/c1-5-34(22-23-35-36(2,3)4,32-28-18-10-6-14-24(28)25-15-7-11-19-29(25)32)33-30-20-12-8-16-26(30)27-17-9-13-21-31(27)33/h6-21,32-33H,5,22-23H2,1-4H3
InChIKeyNHSQVBBKHNIACC-UHFFFAOYSA-N
XLogP9.25
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500488.75
LogP ≤ 59.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

[9-[[Dimethyl(1-phenylethyl)silyl]oxymethyl]-2-fluorofluoren-9-yl]methoxy-dimethyl-(1-phenylethyl)silane
CID 22639108
[9-[[Dimethyl(phenyl)silyl]oxymethyl]-2-fluorofluoren-9-yl]methoxy-dimethyl-phenylsilane
CID 22639129
[2-Fluoro-9-(triphenylsilyloxymethyl)fluoren-9-yl]methoxy-triphenylsilane
CID 22639130
[9-[[Dimethyl(2-phenylethyl)silyl]oxymethyl]-2-fluorofluoren-9-yl]methoxy-dimethyl-(2-phenylethyl)silane
CID 69304700
CID 69304704
CID 69304704
Benzyl-[[9-[[benzyl(dimethyl)silyl]oxymethyl]-2-fluorofluoren-9-yl]methoxy]-dimethylsilane
CID 69305262
Tert-butyl-[3-[5-fluoro-1-(4-fluorophenyl)-2,3-dihydroinden-1-yl]propoxy]-dimethylsilane
CID 69539183
[9-[[Dimethyl-(4-methylphenyl)silyl]oxymethyl]-2-fluorofluoren-9-yl]methoxy-dimethyl-(4-methylphenyl)silane
CID 69614493
[9-[[Dimethyl-(2-methylphenyl)silyl]oxymethyl]-2-fluorofluoren-9-yl]methoxy-dimethyl-(2-methylphenyl)silane
CID 69614494
2,2-Dimethylpropyl-[3-[5-fluoro-1-(4-fluorophenyl)-2,3-dihydroinden-1-yl]propoxy]-dimethylsilane
CID 141125794
7,7'-Di-t-amyl-9,9,9',9'-tetrakis(2-methoxyethyl)-2,2'-bifluorene
CID 129777162
tert-butyl-[[(3S,5R,6R,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-6-[(Z)-4-phenylbut-1-enyl]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-dimethylsilane
CID 134849416

Frequently Asked Questions

What is the IUPAC name of 3,3-bis(9H-fluoren-9-yl)pentoxy-trimethylsilane?
The IUPAC name of 3,3-bis(9H-fluoren-9-yl)pentoxy-trimethylsilane (CID 18622633) is 3,3-bis(9H-fluoren-9-yl)pentoxy-trimethylsilane.
What is the SMILES notation for 3,3-bis(9H-fluoren-9-yl)pentoxy-trimethylsilane?
The canonical SMILES for 3,3-bis(9H-fluoren-9-yl)pentoxy-trimethylsilane is CCC(CCO[Si](C)(C)C)(C1c2ccccc2-c2ccccc21)C1c2ccccc2-c2ccccc21.
What is the InChIKey of 3,3-bis(9H-fluoren-9-yl)pentoxy-trimethylsilane?
The InChIKey is NHSQVBBKHNIACC-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H36OSi/c1-5-34(22-23-35-36(2,3)4,32-28-18-10-6-14-24(28)25-15-7-11-19-29(25)32)33-30-20-12-8-16-26(30)27-17-9-13-21-31(27)33/h6-21,32-33H,5,22-23H2,1-4H3.
What are the key properties of 3,3-bis(9H-fluoren-9-yl)pentoxy-trimethylsilane?
3,3-bis(9H-fluoren-9-yl)pentoxy-trimethylsilane has a molecular weight of 488.75 g/mol, XLogP of 9.25, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-bis(9H-fluoren-9-yl)pentoxy-trimethylsilane is sourced from PubChem (CID 18622633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).