(E)-9-trimethylsilylnon-6-en-8-yn-1-ol

C12H22OSi — CID 135044807

IUPAC(E)-9-trimethylsilylnon-6-en-8-yn-1-ol
SMILESC[Si](C)(C)C#C/C=C/CCCCCO
InChIInChI=1S/C12H22OSi/c1-14(2,3)12-10-8-6-4-5-7-9-11-13/h6,8,13H,4-5,7,9,11H2,1-3H3/b8-6+
InChIKeyXBMYMEVCZXPNGO-SOFGYWHQSA-N
MW210.39 g/mol
LogP2.98
Rot. Bonds5

About (E)-9-trimethylsilylnon-6-en-8-yn-1-ol

(E)-9-trimethylsilylnon-6-en-8-yn-1-ol (PubChem CID 135044807) has the molecular formula C12H22OSi and a molecular weight of 210.39 g/mol. Its IUPAC name is (E)-9-trimethylsilylnon-6-en-8-yn-1-ol.

Molecular Properties

Compound Name(E)-9-trimethylsilylnon-6-en-8-yn-1-ol
PubChem CID135044807
Molecular FormulaC12H22OSi
Molecular Weight210.39 g/mol
Exact Mass210.14
IUPAC Name(E)-9-trimethylsilylnon-6-en-8-yn-1-ol
SMILESC[Si](C)(C)C#C/C=C/CCCCCO
InChIInChI=1S/C12H22OSi/c1-14(2,3)12-10-8-6-4-5-7-9-11-13/h6,8,13H,4-5,7,9,11H2,1-3H3/b8-6+
InChIKeyXBMYMEVCZXPNGO-SOFGYWHQSA-N
XLogP2.98
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.39
LogP ≤ 52.98
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

(Z)-6-trimethylsilylhex-4-en-1-ol
CID 14080211
(Z,5R,6R)-5-trimethylsilylundec-3-en-6-ol
CID 14216572
(E)-1-trimethylsilyldec-3-en-1-yn-5-ol
CID 15176337
6-(Trimethylsilyl)hex-4-en-1-ol
CID 71331812
Trimethylsilyl-2-octene-7-ol
CID 72727162
(Z,4S,5R)-4-trimethylsilylnon-2-en-5-ol
CID 101513168
(3S)-1-trimethylsilyloct-7-en-1-yn-3-ol
CID 102063168
(Z)-8-trimethylsilyloct-6-en-1-ol
CID 134901112
(5Z,8E,10Z,13E)-10-methyl-8-(trimethylsilylmethylidene)pentadeca-5,10,13-trien-1-ol
CID 135008828
(Z,5R)-1-trimethylsilyldec-3-en-1-yn-5-ol
CID 146161389
(Z)-1-trimethylsilyldec-3-en-1-yn-5-ol
CID 146162963
(Z,5S)-1-trimethylsilyldec-3-en-1-yn-5-ol
CID 146163199

Frequently Asked Questions

What is the IUPAC name of (E)-9-trimethylsilylnon-6-en-8-yn-1-ol?
The IUPAC name of (E)-9-trimethylsilylnon-6-en-8-yn-1-ol (CID 135044807) is (E)-9-trimethylsilylnon-6-en-8-yn-1-ol.
What is the SMILES notation for (E)-9-trimethylsilylnon-6-en-8-yn-1-ol?
The canonical SMILES for (E)-9-trimethylsilylnon-6-en-8-yn-1-ol is C[Si](C)(C)C#C/C=C/CCCCCO.
What is the InChIKey of (E)-9-trimethylsilylnon-6-en-8-yn-1-ol?
The InChIKey is XBMYMEVCZXPNGO-SOFGYWHQSA-N. The full InChI is InChI=1S/C12H22OSi/c1-14(2,3)12-10-8-6-4-5-7-9-11-13/h6,8,13H,4-5,7,9,11H2,1-3H3/b8-6+.
What are the key properties of (E)-9-trimethylsilylnon-6-en-8-yn-1-ol?
(E)-9-trimethylsilylnon-6-en-8-yn-1-ol has a molecular weight of 210.39 g/mol, XLogP of 2.98, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-9-trimethylsilylnon-6-en-8-yn-1-ol is sourced from PubChem (CID 135044807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).