5-ethynylnon-1-en-8-yn-5-yloxy-dimethyl-prop-2-enylsilane

C16H24OSi — CID 15247300

IUPAC5-ethynylnon-1-en-8-yn-5-yloxy-dimethyl-prop-2-enylsilane
SMILESC#CCCC(C#C)(CCC=C)O[Si](C)(C)CC=C
InChIInChI=1S/C16H24OSi/c1-7-11-13-16(10-4,14-12-8-2)17-18(5,6)15-9-3/h1,4,8-9H,2-3,11-15H2,5-6H3
InChIKeyDTTGZBZSHTUKNT-UHFFFAOYSA-N
MW260.45 g/mol
LogP4.15
Rot. Bonds9

About 5-ethynylnon-1-en-8-yn-5-yloxy-dimethyl-prop-2-enylsilane

5-ethynylnon-1-en-8-yn-5-yloxy-dimethyl-prop-2-enylsilane (PubChem CID 15247300) has the molecular formula C16H24OSi and a molecular weight of 260.45 g/mol. Its IUPAC name is 5-ethynylnon-1-en-8-yn-5-yloxy-dimethyl-prop-2-enylsilane.

Molecular Properties

Compound Name5-ethynylnon-1-en-8-yn-5-yloxy-dimethyl-prop-2-enylsilane
PubChem CID15247300
Molecular FormulaC16H24OSi
Molecular Weight260.45 g/mol
Exact Mass260.16
IUPAC Name5-ethynylnon-1-en-8-yn-5-yloxy-dimethyl-prop-2-enylsilane
SMILESC#CCCC(C#C)(CCC=C)O[Si](C)(C)CC=C
InChIInChI=1S/C16H24OSi/c1-7-11-13-16(10-4,14-12-8-2)17-18(5,6)15-9-3/h1,4,8-9H,2-3,11-15H2,5-6H3
InChIKeyDTTGZBZSHTUKNT-UHFFFAOYSA-N
XLogP4.15
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.45
LogP ≤ 54.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

5-Ethynylnon-1-en-8-yn-5-yloxy(trimethyl)silane
CID 10988206
[(Z)-7-but-3-enylhexadec-14-en-1,5,10-triyn-7-yl]oxy-tert-butyl-dimethylsilane
CID 10786952
tri(propan-2-yl)-[(3S)-3-prop-2-enylhept-1-ynoxy]silane
CID 10968867
Triethyl(5-prop-1-ynyldeca-1,9-dien-5-yloxy)silane
CID 11748805
Triethyl(6-prop-1-ynylundeca-1,10-dien-6-yloxy)silane
CID 14936189
triethyl-[(9E)-5-prop-1-ynylundeca-1,9-dien-5-yl]oxysilane
CID 14936192
triethyl-[(9Z)-6-prop-1-ynyldodeca-1,9-dien-6-yl]oxysilane
CID 101673816
Tert-butyl-dimethyl-(3-methylnon-8-en-1-yn-3-yloxy)silane
CID 122395882
Lithium;copper(1+);pent-1-yne;triethyl(4-methyloct-1-en-4-yloxy)silane
CID 134990695
tert-butyl-[(5S,6R)-6-ethynyldec-9-en-1-yn-5-yl]oxy-dimethylsilane
CID 162406243
[(Z,7S)-7-but-3-enylhexadec-14-en-1,5,10-triyn-7-yl]oxy-tert-butyl-dimethylsilane
CID 176431397
Tert-butyl-(5-ethynylnona-1,8-dien-5-yloxy)-dimethylsilane
CID 15247303

Frequently Asked Questions

What is the IUPAC name of 5-ethynylnon-1-en-8-yn-5-yloxy-dimethyl-prop-2-enylsilane?
The IUPAC name of 5-ethynylnon-1-en-8-yn-5-yloxy-dimethyl-prop-2-enylsilane (CID 15247300) is 5-ethynylnon-1-en-8-yn-5-yloxy-dimethyl-prop-2-enylsilane.
What is the SMILES notation for 5-ethynylnon-1-en-8-yn-5-yloxy-dimethyl-prop-2-enylsilane?
The canonical SMILES for 5-ethynylnon-1-en-8-yn-5-yloxy-dimethyl-prop-2-enylsilane is C#CCCC(C#C)(CCC=C)O[Si](C)(C)CC=C.
What is the InChIKey of 5-ethynylnon-1-en-8-yn-5-yloxy-dimethyl-prop-2-enylsilane?
The InChIKey is DTTGZBZSHTUKNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24OSi/c1-7-11-13-16(10-4,14-12-8-2)17-18(5,6)15-9-3/h1,4,8-9H,2-3,11-15H2,5-6H3.
What are the key properties of 5-ethynylnon-1-en-8-yn-5-yloxy-dimethyl-prop-2-enylsilane?
5-ethynylnon-1-en-8-yn-5-yloxy-dimethyl-prop-2-enylsilane has a molecular weight of 260.45 g/mol, XLogP of 4.15, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethynylnon-1-en-8-yn-5-yloxy-dimethyl-prop-2-enylsilane is sourced from PubChem (CID 15247300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).