2-methyl-5-trimethylsilylnon-3-yn-2-ol

C13H26OSi — CID 10082429

IUPAC2-methyl-5-trimethylsilylnon-3-yn-2-ol
SMILESCCCCC(C#CC(C)(C)O)[Si](C)(C)C
InChIInChI=1S/C13H26OSi/c1-7-8-9-12(15(4,5)6)10-11-13(2,3)14/h12,14H,7-9H2,1-6H3
InChIKeyGBBVLOKGKVCZEJ-UHFFFAOYSA-N
MW226.44 g/mol
LogP3.66
Rot. Bonds4

About 2-methyl-5-trimethylsilylnon-3-yn-2-ol

2-methyl-5-trimethylsilylnon-3-yn-2-ol (PubChem CID 10082429) has the molecular formula C13H26OSi and a molecular weight of 226.44 g/mol. Its IUPAC name is 2-methyl-5-trimethylsilylnon-3-yn-2-ol.

Molecular Properties

Compound Name2-methyl-5-trimethylsilylnon-3-yn-2-ol
PubChem CID10082429
Molecular FormulaC13H26OSi
Molecular Weight226.44 g/mol
Exact Mass226.18
IUPAC Name2-methyl-5-trimethylsilylnon-3-yn-2-ol
SMILESCCCCC(C#CC(C)(C)O)[Si](C)(C)C
InChIInChI=1S/C13H26OSi/c1-7-8-9-12(15(4,5)6)10-11-13(2,3)14/h12,14H,7-9H2,1-6H3
InChIKeyGBBVLOKGKVCZEJ-UHFFFAOYSA-N
XLogP3.66
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.44
LogP ≤ 53.66
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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Related Compounds

2-Methyl-4-(trimethylsilyl)but-3-yn-2-ol
CID 332724
3-Ethyl-1-trimethylsilanyl-pent-1-yn-3-ol
CID 15526815
6-Trimethylsilyl-2-methylhexa-3,5-diyn-2-ol
CID 10678951
3-Methyl-1-(trimethylsilyl)pent-1-yn-3-ol
CID 12630623
Fluoro-2-methyl-4-triethylsilyl-but-3-yn-2-ol
CID 86693093
2-Trimethylsilyloct-3-yn-2-ol
CID 15500752
(3S)-3-methyl-6-trimethylsilylhex-5-yn-3-ol
CID 53483592
Hept-1-ynyl-dimethyl-[(2-methylpropan-2-yl)oxy]silane
CID 102287855
7-Trimethylsilyl-2,5,5-trimethyl-3,6-heptadiyn-2-ol
CID 129805983
6-Dimethylethylsilyl-2-methylhexa-3,5-diyn-2-ol
CID 129806516
2-[Tert-butyl(dimethyl)silyl]-4-trimethylsilylbut-3-yn-2-ol
CID 135068800
1-Trimethylsilyl-3-(2-trimethylsilylethynyl)heptadeca-1,4-diyn-3-ol
CID 138980138

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-trimethylsilylnon-3-yn-2-ol?
The IUPAC name of 2-methyl-5-trimethylsilylnon-3-yn-2-ol (CID 10082429) is 2-methyl-5-trimethylsilylnon-3-yn-2-ol.
What is the SMILES notation for 2-methyl-5-trimethylsilylnon-3-yn-2-ol?
The canonical SMILES for 2-methyl-5-trimethylsilylnon-3-yn-2-ol is CCCCC(C#CC(C)(C)O)[Si](C)(C)C.
What is the InChIKey of 2-methyl-5-trimethylsilylnon-3-yn-2-ol?
The InChIKey is GBBVLOKGKVCZEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26OSi/c1-7-8-9-12(15(4,5)6)10-11-13(2,3)14/h12,14H,7-9H2,1-6H3.
What are the key properties of 2-methyl-5-trimethylsilylnon-3-yn-2-ol?
2-methyl-5-trimethylsilylnon-3-yn-2-ol has a molecular weight of 226.44 g/mol, XLogP of 3.66, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-trimethylsilylnon-3-yn-2-ol is sourced from PubChem (CID 10082429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).