(1,8-dibromo-7-trimethylsilyloxynaphthalen-2-yl)oxy-trimethylsilane

C16H22Br2O2Si2 — CID 132579889

IUPAC(1,8-dibromo-7-trimethylsilyloxynaphthalen-2-yl)oxy-trimethylsilane
SMILESC[Si](C)(C)Oc1ccc2ccc(O[Si](C)(C)C)c(Br)c2c1Br
InChIInChI=1S/C16H22Br2O2Si2/c1-21(2,3)19-12-9-7-11-8-10-13(20-22(4,5)6)16(18)14(11)15(12)17/h7-10H,1-6H3
InChIKeyRFMDVMVYKNFROI-UHFFFAOYSA-N
MW462.33 g/mol
LogP6.79
Rot. Bonds4

About (1,8-dibromo-7-trimethylsilyloxynaphthalen-2-yl)oxy-trimethylsilane

(1,8-dibromo-7-trimethylsilyloxynaphthalen-2-yl)oxy-trimethylsilane (PubChem CID 132579889) has the molecular formula C16H22Br2O2Si2 and a molecular weight of 462.33 g/mol. Its IUPAC name is (1,8-dibromo-7-trimethylsilyloxynaphthalen-2-yl)oxy-trimethylsilane.

Molecular Properties

Compound Name(1,8-dibromo-7-trimethylsilyloxynaphthalen-2-yl)oxy-trimethylsilane
PubChem CID132579889
Molecular FormulaC16H22Br2O2Si2
Molecular Weight462.33 g/mol
Exact Mass459.95
IUPAC Name(1,8-dibromo-7-trimethylsilyloxynaphthalen-2-yl)oxy-trimethylsilane
SMILESC[Si](C)(C)Oc1ccc2ccc(O[Si](C)(C)C)c(Br)c2c1Br
InChIInChI=1S/C16H22Br2O2Si2/c1-21(2,3)19-12-9-7-11-8-10-13(20-22(4,5)6)16(18)14(11)15(12)17/h7-10H,1-6H3
InChIKeyRFMDVMVYKNFROI-UHFFFAOYSA-N
XLogP6.79
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500462.33
LogP ≤ 56.79
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 (1,8-dibromo-7-trimethylsilyloxynaphthalen-2-yl)oxy-trimethylsilane?
The IUPAC name of (1,8-dibromo-7-trimethylsilyloxynaphthalen-2-yl)oxy-trimethylsilane (CID 132579889) is (1,8-dibromo-7-trimethylsilyloxynaphthalen-2-yl)oxy-trimethylsilane.
What is the SMILES notation for (1,8-dibromo-7-trimethylsilyloxynaphthalen-2-yl)oxy-trimethylsilane?
The canonical SMILES for (1,8-dibromo-7-trimethylsilyloxynaphthalen-2-yl)oxy-trimethylsilane is C[Si](C)(C)Oc1ccc2ccc(O[Si](C)(C)C)c(Br)c2c1Br.
What is the InChIKey of (1,8-dibromo-7-trimethylsilyloxynaphthalen-2-yl)oxy-trimethylsilane?
The InChIKey is RFMDVMVYKNFROI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22Br2O2Si2/c1-21(2,3)19-12-9-7-11-8-10-13(20-22(4,5)6)16(18)14(11)15(12)17/h7-10H,1-6H3.
What are the key properties of (1,8-dibromo-7-trimethylsilyloxynaphthalen-2-yl)oxy-trimethylsilane?
(1,8-dibromo-7-trimethylsilyloxynaphthalen-2-yl)oxy-trimethylsilane has a molecular weight of 462.33 g/mol, XLogP of 6.79, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1,8-dibromo-7-trimethylsilyloxynaphthalen-2-yl)oxy-trimethylsilane is sourced from PubChem (CID 132579889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).