1-[tert-butyl(dimethyl)silyl]-3-trimethylsilylprop-2-yn-1-ol

C12H26OSi2 — CID 11032078

IUPAC1-[tert-butyl(dimethyl)silyl]-3-trimethylsilylprop-2-yn-1-ol
SMILESCC(C)(C)[Si](C)(C)C(O)C#C[Si](C)(C)C
InChIInChI=1S/C12H26OSi2/c1-12(2,3)15(7,8)11(13)9-10-14(4,5)6/h11,13H,1-8H3
InChIKeyRNBKYMVETLYQLJ-UHFFFAOYSA-N
MW242.51 g/mol
LogP3.28
Rot. Bonds1

About 1-[tert-butyl(dimethyl)silyl]-3-trimethylsilylprop-2-yn-1-ol

1-[tert-butyl(dimethyl)silyl]-3-trimethylsilylprop-2-yn-1-ol (PubChem CID 11032078) has the molecular formula C12H26OSi2 and a molecular weight of 242.51 g/mol. Its IUPAC name is 1-[tert-butyl(dimethyl)silyl]-3-trimethylsilylprop-2-yn-1-ol.

Molecular Properties

Compound Name1-[tert-butyl(dimethyl)silyl]-3-trimethylsilylprop-2-yn-1-ol
PubChem CID11032078
Molecular FormulaC12H26OSi2
Molecular Weight242.51 g/mol
Exact Mass242.15
IUPAC Name1-[tert-butyl(dimethyl)silyl]-3-trimethylsilylprop-2-yn-1-ol
SMILESCC(C)(C)[Si](C)(C)C(O)C#C[Si](C)(C)C
InChIInChI=1S/C12H26OSi2/c1-12(2,3)15(7,8)11(13)9-10-14(4,5)6/h11,13H,1-8H3
InChIKeyRNBKYMVETLYQLJ-UHFFFAOYSA-N
XLogP3.28
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.51
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-[tert-butyl(dimethyl)silyl]-3-trimethylsilylprop-2-yn-1-ol?
The IUPAC name of 1-[tert-butyl(dimethyl)silyl]-3-trimethylsilylprop-2-yn-1-ol (CID 11032078) is 1-[tert-butyl(dimethyl)silyl]-3-trimethylsilylprop-2-yn-1-ol.
What is the SMILES notation for 1-[tert-butyl(dimethyl)silyl]-3-trimethylsilylprop-2-yn-1-ol?
The canonical SMILES for 1-[tert-butyl(dimethyl)silyl]-3-trimethylsilylprop-2-yn-1-ol is CC(C)(C)[Si](C)(C)C(O)C#C[Si](C)(C)C.
What is the InChIKey of 1-[tert-butyl(dimethyl)silyl]-3-trimethylsilylprop-2-yn-1-ol?
The InChIKey is RNBKYMVETLYQLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26OSi2/c1-12(2,3)15(7,8)11(13)9-10-14(4,5)6/h11,13H,1-8H3.
What are the key properties of 1-[tert-butyl(dimethyl)silyl]-3-trimethylsilylprop-2-yn-1-ol?
1-[tert-butyl(dimethyl)silyl]-3-trimethylsilylprop-2-yn-1-ol has a molecular weight of 242.51 g/mol, XLogP of 3.28, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[tert-butyl(dimethyl)silyl]-3-trimethylsilylprop-2-yn-1-ol is sourced from PubChem (CID 11032078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).