9-trimethylsilylnona-1,8-diyn-3-ol

C12H20OSi — CID 171642288

IUPAC9-trimethylsilylnona-1,8-diyn-3-ol
SMILESC#CC(O)CCCCC#C[Si](C)(C)C
InChIInChI=1S/C12H20OSi/c1-5-12(13)10-8-6-7-9-11-14(2,3)4/h1,12-13H,6-8,10H2,2-4H3
InChIKeyIYSDMLXCSOXXCC-UHFFFAOYSA-N
MW208.38 g/mol
LogP2.42
Rot. Bonds4

About 9-trimethylsilylnona-1,8-diyn-3-ol

9-trimethylsilylnona-1,8-diyn-3-ol (PubChem CID 171642288) has the molecular formula C12H20OSi and a molecular weight of 208.38 g/mol. Its IUPAC name is 9-trimethylsilylnona-1,8-diyn-3-ol.

Molecular Properties

Compound Name9-trimethylsilylnona-1,8-diyn-3-ol
PubChem CID171642288
Molecular FormulaC12H20OSi
Molecular Weight208.38 g/mol
Exact Mass208.13
IUPAC Name9-trimethylsilylnona-1,8-diyn-3-ol
SMILESC#CC(O)CCCCC#C[Si](C)(C)C
InChIInChI=1S/C12H20OSi/c1-5-12(13)10-8-6-7-9-11-14(2,3)4/h1,12-13H,6-8,10H2,2-4H3
InChIKeyIYSDMLXCSOXXCC-UHFFFAOYSA-N
XLogP2.42
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.38
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(5R)-1-tri(propan-2-yl)silyltetradeca-1,3-diyn-5-ol
CID 164610642
(3S)-1-trimethylsilyloct-1-yn-3-ol
CID 12447768
1-Tri(propan-2-yl)silyldodec-1-yn-4-ol
CID 12120914
7-Trimethylsilylhept-6-yne-1,5-diol
CID 23240932
1-Decyn-3-ol, 1-(trimethylsilyl)-
CID 10955284
7-(Trimethylsilyl)hept-6-yn-1-ol
CID 11183041
(S)-1-(trimethylsilyl)hept-1-yn-3-ol
CID 12623485
1-Trimethylsilylnon-1-yn-3-ol
CID 15695620
4-[Tert-butyl(dimethyl)silyl]oxynon-2-yn-1-ol
CID 85825729
(5S)-1-trimethylsilyldec-1-yn-5-ol
CID 135001882
4,4-Difluoro-1-trimethylsilyloct-1-yn-3-ol
CID 23389310
(3S)-4,4-difluoro-1-trimethylsilyloct-1-yn-3-ol
CID 59094281

Frequently Asked Questions

What is the IUPAC name of 9-trimethylsilylnona-1,8-diyn-3-ol?
The IUPAC name of 9-trimethylsilylnona-1,8-diyn-3-ol (CID 171642288) is 9-trimethylsilylnona-1,8-diyn-3-ol.
What is the SMILES notation for 9-trimethylsilylnona-1,8-diyn-3-ol?
The canonical SMILES for 9-trimethylsilylnona-1,8-diyn-3-ol is C#CC(O)CCCCC#C[Si](C)(C)C.
What is the InChIKey of 9-trimethylsilylnona-1,8-diyn-3-ol?
The InChIKey is IYSDMLXCSOXXCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20OSi/c1-5-12(13)10-8-6-7-9-11-14(2,3)4/h1,12-13H,6-8,10H2,2-4H3.
What are the key properties of 9-trimethylsilylnona-1,8-diyn-3-ol?
9-trimethylsilylnona-1,8-diyn-3-ol has a molecular weight of 208.38 g/mol, XLogP of 2.42, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-trimethylsilylnona-1,8-diyn-3-ol is sourced from PubChem (CID 171642288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).