benzyl-[[9-[[benzyl(dimethyl)silyl]oxymethyl]-2-fluorofluoren-9-yl]methoxy]-dimethylsilane

C33H37FO2Si2 — CID 69305262

IUPACbenzyl-[[9-[[benzyl(dimethyl)silyl]oxymethyl]-2-fluorofluoren-9-yl]methoxy]-dimethylsilane
SMILESC[Si](C)(Cc1ccccc1)OCC1(CO[Si](C)(C)Cc2ccccc2)c2ccccc2-c2ccc(F)cc21
InChIInChI=1S/C33H37FO2Si2/c1-37(2,22-26-13-7-5-8-14-26)35-24-33(25-36-38(3,4)23-27-15-9-6-10-16-27)31-18-12-11-17-29(31)30-20-19-28(34)21-32(30)33/h5-21H,22-25H2,1-4H3
InChIKeyGXHGWTCSVALSTB-UHFFFAOYSA-N
MW540.83 g/mol
LogP8.10
Rot. Bonds10

About benzyl-[[9-[[benzyl(dimethyl)silyl]oxymethyl]-2-fluorofluoren-9-yl]methoxy]-dimethylsilane

benzyl-[[9-[[benzyl(dimethyl)silyl]oxymethyl]-2-fluorofluoren-9-yl]methoxy]-dimethylsilane (PubChem CID 69305262) has the molecular formula C33H37FO2Si2 and a molecular weight of 540.83 g/mol. Its IUPAC name is benzyl-[[9-[[benzyl(dimethyl)silyl]oxymethyl]-2-fluorofluoren-9-yl]methoxy]-dimethylsilane.

Molecular Properties

Compound Namebenzyl-[[9-[[benzyl(dimethyl)silyl]oxymethyl]-2-fluorofluoren-9-yl]methoxy]-dimethylsilane
PubChem CID69305262
Molecular FormulaC33H37FO2Si2
Molecular Weight540.83 g/mol
Exact Mass540.23
IUPAC Namebenzyl-[[9-[[benzyl(dimethyl)silyl]oxymethyl]-2-fluorofluoren-9-yl]methoxy]-dimethylsilane
SMILESC[Si](C)(Cc1ccccc1)OCC1(CO[Si](C)(C)Cc2ccccc2)c2ccccc2-c2ccc(F)cc21
InChIInChI=1S/C33H37FO2Si2/c1-37(2,22-26-13-7-5-8-14-26)35-24-33(25-36-38(3,4)23-27-15-9-6-10-16-27)31-18-12-11-17-29(31)30-20-19-28(34)21-32(30)33/h5-21H,22-25H2,1-4H3
InChIKeyGXHGWTCSVALSTB-UHFFFAOYSA-N
XLogP8.10
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms38
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500540.83
LogP ≤ 58.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of benzyl-[[9-[[benzyl(dimethyl)silyl]oxymethyl]-2-fluorofluoren-9-yl]methoxy]-dimethylsilane?
The IUPAC name of benzyl-[[9-[[benzyl(dimethyl)silyl]oxymethyl]-2-fluorofluoren-9-yl]methoxy]-dimethylsilane (CID 69305262) is benzyl-[[9-[[benzyl(dimethyl)silyl]oxymethyl]-2-fluorofluoren-9-yl]methoxy]-dimethylsilane.
What is the SMILES notation for benzyl-[[9-[[benzyl(dimethyl)silyl]oxymethyl]-2-fluorofluoren-9-yl]methoxy]-dimethylsilane?
The canonical SMILES for benzyl-[[9-[[benzyl(dimethyl)silyl]oxymethyl]-2-fluorofluoren-9-yl]methoxy]-dimethylsilane is C[Si](C)(Cc1ccccc1)OCC1(CO[Si](C)(C)Cc2ccccc2)c2ccccc2-c2ccc(F)cc21.
What is the InChIKey of benzyl-[[9-[[benzyl(dimethyl)silyl]oxymethyl]-2-fluorofluoren-9-yl]methoxy]-dimethylsilane?
The InChIKey is GXHGWTCSVALSTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H37FO2Si2/c1-37(2,22-26-13-7-5-8-14-26)35-24-33(25-36-38(3,4)23-27-15-9-6-10-16-27)31-18-12-11-17-29(31)30-20-19-28(34)21-32(30)33/h5-21H,22-25H2,1-4H3.
What are the key properties of benzyl-[[9-[[benzyl(dimethyl)silyl]oxymethyl]-2-fluorofluoren-9-yl]methoxy]-dimethylsilane?
benzyl-[[9-[[benzyl(dimethyl)silyl]oxymethyl]-2-fluorofluoren-9-yl]methoxy]-dimethylsilane has a molecular weight of 540.83 g/mol, XLogP of 8.10, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for benzyl-[[9-[[benzyl(dimethyl)silyl]oxymethyl]-2-fluorofluoren-9-yl]methoxy]-dimethylsilane is sourced from PubChem (CID 69305262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).