2,4,7,9-tetramethyl-7-trimethylsilyloxydec-5-yn-4-ol

C17H34O2Si — CID 91737715

IUPAC2,4,7,9-tetramethyl-7-trimethylsilyloxydec-5-yn-4-ol
SMILESCC(C)CC(C)(O)C#CC(C)(CC(C)C)O[Si](C)(C)C
InChIInChI=1S/C17H34O2Si/c1-14(2)12-16(5,18)10-11-17(6,13-15(3)4)19-20(7,8)9/h14-15,18H,12-13H2,1-9H3
InChIKeyIROIECUUWYBATO-UHFFFAOYSA-N
MW298.54 g/mol
LogP4.44
Rot. Bonds6

About 2,4,7,9-tetramethyl-7-trimethylsilyloxydec-5-yn-4-ol

2,4,7,9-tetramethyl-7-trimethylsilyloxydec-5-yn-4-ol (PubChem CID 91737715) has the molecular formula C17H34O2Si and a molecular weight of 298.54 g/mol. Its IUPAC name is 2,4,7,9-tetramethyl-7-trimethylsilyloxydec-5-yn-4-ol.

Molecular Properties

Compound Name2,4,7,9-tetramethyl-7-trimethylsilyloxydec-5-yn-4-ol
PubChem CID91737715
Molecular FormulaC17H34O2Si
Molecular Weight298.54 g/mol
Exact Mass298.23
IUPAC Name2,4,7,9-tetramethyl-7-trimethylsilyloxydec-5-yn-4-ol
SMILESCC(C)CC(C)(O)C#CC(C)(CC(C)C)O[Si](C)(C)C
InChIInChI=1S/C17H34O2Si/c1-14(2)12-16(5,18)10-11-17(6,13-15(3)4)19-20(7,8)9/h14-15,18H,12-13H2,1-9H3
InChIKeyIROIECUUWYBATO-UHFFFAOYSA-N
XLogP4.44
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.54
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4,7-Bis(trimethylsiloxy)-2,4,7,9-tetramethyl-5-decyne
CID 91696953
Bis(3,5-dimethylhex-1-yn-3-yloxy)-dimethylsilane
CID 23450486
[(3R)-3,5-dimethylhex-1-yn-3-yl]oxy-[(3S)-3,5-dimethylhex-1-yn-3-yl]oxy-dimethylsilane
CID 54269959
Dec-5-yne;2,4,7,9-tetramethyldec-5-yne-4,7-diol
CID 87658423
Tert-butyl-dimethyl-[1,1,1-trideuterio-2-(trideuteriomethyl)hex-5-yn-2-yl]oxysilane;1,1,1-trideuterio-2-(trideuteriomethyl)hex-5-yn-2-ol
CID 165029410
Tert-butyl-dimethyl-(2-methylhex-5-yn-2-yloxy)silane;2-methylhex-5-yn-2-ol
CID 165029411
5-[Tert-butyl(dimethyl)silyl]oxy-2,6-dimethyl-5-propan-2-ylhept-3-yn-2-ol
CID 53253534

Frequently Asked Questions

What is the IUPAC name of 2,4,7,9-tetramethyl-7-trimethylsilyloxydec-5-yn-4-ol?
The IUPAC name of 2,4,7,9-tetramethyl-7-trimethylsilyloxydec-5-yn-4-ol (CID 91737715) is 2,4,7,9-tetramethyl-7-trimethylsilyloxydec-5-yn-4-ol.
What is the SMILES notation for 2,4,7,9-tetramethyl-7-trimethylsilyloxydec-5-yn-4-ol?
The canonical SMILES for 2,4,7,9-tetramethyl-7-trimethylsilyloxydec-5-yn-4-ol is CC(C)CC(C)(O)C#CC(C)(CC(C)C)O[Si](C)(C)C.
What is the InChIKey of 2,4,7,9-tetramethyl-7-trimethylsilyloxydec-5-yn-4-ol?
The InChIKey is IROIECUUWYBATO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34O2Si/c1-14(2)12-16(5,18)10-11-17(6,13-15(3)4)19-20(7,8)9/h14-15,18H,12-13H2,1-9H3.
What are the key properties of 2,4,7,9-tetramethyl-7-trimethylsilyloxydec-5-yn-4-ol?
2,4,7,9-tetramethyl-7-trimethylsilyloxydec-5-yn-4-ol has a molecular weight of 298.54 g/mol, XLogP of 4.44, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,7,9-tetramethyl-7-trimethylsilyloxydec-5-yn-4-ol is sourced from PubChem (CID 91737715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).