2-adamantyl-[tert-butyl(dimethyl)silyl]-methoxy-trimethylsilylsilane

C20H42OSi3 — CID 15247569

IUPAC2-adamantyl-[tert-butyl(dimethyl)silyl]-methoxy-trimethylsilylsilane
SMILESCO[Si](C1C2CC3CC(C2)CC1C3)([Si](C)(C)C)[Si](C)(C)C(C)(C)C
InChIInChI=1S/C20H42OSi3/c1-20(2,3)23(8,9)24(21-4,22(5,6)7)19-17-11-15-10-16(13-17)14-18(19)12-15/h15-19H,10-14H2,1-9H3
InChIKeyMGOWYLXKVDQZLI-UHFFFAOYSA-N
MW382.81 g/mol
LogP6.41
Rot. Bonds4

About 2-adamantyl-[tert-butyl(dimethyl)silyl]-methoxy-trimethylsilylsilane

2-adamantyl-[tert-butyl(dimethyl)silyl]-methoxy-trimethylsilylsilane (PubChem CID 15247569) has the molecular formula C20H42OSi3 and a molecular weight of 382.81 g/mol. Its IUPAC name is 2-adamantyl-[tert-butyl(dimethyl)silyl]-methoxy-trimethylsilylsilane.

Molecular Properties

Compound Name2-adamantyl-[tert-butyl(dimethyl)silyl]-methoxy-trimethylsilylsilane
PubChem CID15247569
Molecular FormulaC20H42OSi3
Molecular Weight382.81 g/mol
Exact Mass382.25
IUPAC Name2-adamantyl-[tert-butyl(dimethyl)silyl]-methoxy-trimethylsilylsilane
SMILESCO[Si](C1C2CC3CC(C2)CC1C3)([Si](C)(C)C)[Si](C)(C)C(C)(C)C
InChIInChI=1S/C20H42OSi3/c1-20(2,3)23(8,9)24(21-4,22(5,6)7)19-17-11-15-10-16(13-17)14-18(19)12-15/h15-19H,10-14H2,1-9H3
InChIKeyMGOWYLXKVDQZLI-UHFFFAOYSA-N
XLogP6.41
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500382.81
LogP ≤ 56.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 2-adamantyl-[tert-butyl(dimethyl)silyl]-methoxy-trimethylsilylsilane?
The IUPAC name of 2-adamantyl-[tert-butyl(dimethyl)silyl]-methoxy-trimethylsilylsilane (CID 15247569) is 2-adamantyl-[tert-butyl(dimethyl)silyl]-methoxy-trimethylsilylsilane.
What is the SMILES notation for 2-adamantyl-[tert-butyl(dimethyl)silyl]-methoxy-trimethylsilylsilane?
The canonical SMILES for 2-adamantyl-[tert-butyl(dimethyl)silyl]-methoxy-trimethylsilylsilane is CO[Si](C1C2CC3CC(C2)CC1C3)([Si](C)(C)C)[Si](C)(C)C(C)(C)C.
What is the InChIKey of 2-adamantyl-[tert-butyl(dimethyl)silyl]-methoxy-trimethylsilylsilane?
The InChIKey is MGOWYLXKVDQZLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H42OSi3/c1-20(2,3)23(8,9)24(21-4,22(5,6)7)19-17-11-15-10-16(13-17)14-18(19)12-15/h15-19H,10-14H2,1-9H3.
What are the key properties of 2-adamantyl-[tert-butyl(dimethyl)silyl]-methoxy-trimethylsilylsilane?
2-adamantyl-[tert-butyl(dimethyl)silyl]-methoxy-trimethylsilylsilane has a molecular weight of 382.81 g/mol, XLogP of 6.41, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-adamantyl-[tert-butyl(dimethyl)silyl]-methoxy-trimethylsilylsilane is sourced from PubChem (CID 15247569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).