bis(9H-fluoren-1-yl)-methyl-(3,3,3-trifluoropropyl)silane

C30H25F3Si — CID 22623348

IUPACbis(9H-fluoren-1-yl)-methyl-(3,3,3-trifluoropropyl)silane
SMILESC[Si](CCC(F)(F)F)(c1cccc2c1Cc1ccccc1-2)c1cccc2c1Cc1ccccc1-2
InChIInChI=1S/C30H25F3Si/c1-34(17-16-30(31,32)33,28-14-6-12-24-22-10-4-2-8-20(22)18-26(24)28)29-15-7-13-25-23-11-5-3-9-21(23)19-27(25)29/h2-15H,16-19H2,1H3
InChIKeyVCMSKCVWMISSRI-UHFFFAOYSA-N
MW470.61 g/mol
LogP6.97
Rot. Bonds4

About bis(9H-fluoren-1-yl)-methyl-(3,3,3-trifluoropropyl)silane

bis(9H-fluoren-1-yl)-methyl-(3,3,3-trifluoropropyl)silane (PubChem CID 22623348) has the molecular formula C30H25F3Si and a molecular weight of 470.61 g/mol. Its IUPAC name is bis(9H-fluoren-1-yl)-methyl-(3,3,3-trifluoropropyl)silane.

Molecular Properties

Compound Namebis(9H-fluoren-1-yl)-methyl-(3,3,3-trifluoropropyl)silane
PubChem CID22623348
Molecular FormulaC30H25F3Si
Molecular Weight470.61 g/mol
Exact Mass470.17
IUPAC Namebis(9H-fluoren-1-yl)-methyl-(3,3,3-trifluoropropyl)silane
SMILESC[Si](CCC(F)(F)F)(c1cccc2c1Cc1ccccc1-2)c1cccc2c1Cc1ccccc1-2
InChIInChI=1S/C30H25F3Si/c1-34(17-16-30(31,32)33,28-14-6-12-24-22-10-4-2-8-20(22)18-26(24)28)29-15-7-13-25-23-11-5-3-9-21(23)19-27(25)29/h2-15H,16-19H2,1H3
InChIKeyVCMSKCVWMISSRI-UHFFFAOYSA-N
XLogP6.97
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500470.61
LogP ≤ 56.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 bis(9H-fluoren-1-yl)-methyl-(3,3,3-trifluoropropyl)silane?
The IUPAC name of bis(9H-fluoren-1-yl)-methyl-(3,3,3-trifluoropropyl)silane (CID 22623348) is bis(9H-fluoren-1-yl)-methyl-(3,3,3-trifluoropropyl)silane.
What is the SMILES notation for bis(9H-fluoren-1-yl)-methyl-(3,3,3-trifluoropropyl)silane?
The canonical SMILES for bis(9H-fluoren-1-yl)-methyl-(3,3,3-trifluoropropyl)silane is C[Si](CCC(F)(F)F)(c1cccc2c1Cc1ccccc1-2)c1cccc2c1Cc1ccccc1-2.
What is the InChIKey of bis(9H-fluoren-1-yl)-methyl-(3,3,3-trifluoropropyl)silane?
The InChIKey is VCMSKCVWMISSRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H25F3Si/c1-34(17-16-30(31,32)33,28-14-6-12-24-22-10-4-2-8-20(22)18-26(24)28)29-15-7-13-25-23-11-5-3-9-21(23)19-27(25)29/h2-15H,16-19H2,1H3.
What are the key properties of bis(9H-fluoren-1-yl)-methyl-(3,3,3-trifluoropropyl)silane?
bis(9H-fluoren-1-yl)-methyl-(3,3,3-trifluoropropyl)silane has a molecular weight of 470.61 g/mol, XLogP of 6.97, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis(9H-fluoren-1-yl)-methyl-(3,3,3-trifluoropropyl)silane is sourced from PubChem (CID 22623348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).