About [1-[2,7-bis(trimethylsilyloxy)naphthalen-1-yl]-7-trimethylsilyloxynaphthalen-2-yl]oxy-trimethylsilane
[1-[2,7-bis(trimethylsilyloxy)naphthalen-1-yl]-7-trimethylsilyloxynaphthalen-2-yl]oxy-trimethylsilane (PubChem CID 162501255) has the molecular formula C32H46O4Si4
and a molecular weight of 607.06 g/mol. Its IUPAC name is [1-[2,7-bis(trimethylsilyloxy)naphthalen-1-yl]-7-trimethylsilyloxynaphthalen-2-yl]oxy-trimethylsilane.
Molecular Properties
| Compound Name | [1-[2,7-bis(trimethylsilyloxy)naphthalen-1-yl]-7-trimethylsilyloxynaphthalen-2-yl]oxy-trimethylsilane |
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| PubChem CID | 162501255 |
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| Molecular Formula | C32H46O4Si4 |
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| Molecular Weight | 607.06 g/mol |
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| Exact Mass | 606.25 |
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| IUPAC Name | [1-[2,7-bis(trimethylsilyloxy)naphthalen-1-yl]-7-trimethylsilyloxynaphthalen-2-yl]oxy-trimethylsilane |
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| SMILES | C[Si](C)(C)Oc1ccc2ccc(O[Si](C)(C)C)c(-c3c(O[Si](C)(C)C)ccc4ccc(O[Si](C)(C)C)cc34)c2c1 |
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| InChI | InChI=1S/C32H46O4Si4/c1-37(2,3)33-25-17-13-23-15-19-29(35-39(7,8)9)31(27(23)21-25)32-28-22-26(34-38(4,5)6)18-14-24(28)16-20-30(32)36-40(10,11)12/h13-22H,1-12H3 |
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| InChIKey | MJVFRIFTFFUKEL-UHFFFAOYSA-N |
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| XLogP | 10.51 |
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| TPSA | 36.92 Ų |
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| H-Bond Donors | |
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| H-Bond Acceptors | 4 |
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| Rotatable Bonds | 9 |
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| Heavy Atoms | 40 |
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| Complexity | — |
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Lipinski Rule of Five
2 violations
| Rule | Value |
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| MW ≤ 500 | 607.06 |
| LogP ≤ 5 | 10.51 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 4 |
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 [1-[2,7-bis(trimethylsilyloxy)naphthalen-1-yl]-7-trimethylsilyloxynaphthalen-2-yl]oxy-trimethylsilane?
The IUPAC name of [1-[2,7-bis(trimethylsilyloxy)naphthalen-1-yl]-7-trimethylsilyloxynaphthalen-2-yl]oxy-trimethylsilane (CID 162501255) is [1-[2,7-bis(trimethylsilyloxy)naphthalen-1-yl]-7-trimethylsilyloxynaphthalen-2-yl]oxy-trimethylsilane.
What is the SMILES notation for [1-[2,7-bis(trimethylsilyloxy)naphthalen-1-yl]-7-trimethylsilyloxynaphthalen-2-yl]oxy-trimethylsilane?
The canonical SMILES for [1-[2,7-bis(trimethylsilyloxy)naphthalen-1-yl]-7-trimethylsilyloxynaphthalen-2-yl]oxy-trimethylsilane is C[Si](C)(C)Oc1ccc2ccc(O[Si](C)(C)C)c(-c3c(O[Si](C)(C)C)ccc4ccc(O[Si](C)(C)C)cc34)c2c1.
What is the InChIKey of [1-[2,7-bis(trimethylsilyloxy)naphthalen-1-yl]-7-trimethylsilyloxynaphthalen-2-yl]oxy-trimethylsilane?
The InChIKey is MJVFRIFTFFUKEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H46O4Si4/c1-37(2,3)33-25-17-13-23-15-19-29(35-39(7,8)9)31(27(23)21-25)32-28-22-26(34-38(4,5)6)18-14-24(28)16-20-30(32)36-40(10,11)12/h13-22H,1-12H3.
What are the key properties of [1-[2,7-bis(trimethylsilyloxy)naphthalen-1-yl]-7-trimethylsilyloxynaphthalen-2-yl]oxy-trimethylsilane?
[1-[2,7-bis(trimethylsilyloxy)naphthalen-1-yl]-7-trimethylsilyloxynaphthalen-2-yl]oxy-trimethylsilane has a molecular weight of 607.06 g/mol, XLogP of 10.51, 9 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[2,7-bis(trimethylsilyloxy)naphthalen-1-yl]-7-trimethylsilyloxynaphthalen-2-yl]oxy-trimethylsilane is sourced from PubChem (CID 162501255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).