trimethyl(oct-1-yn-3-yl)silane

C11H22Si — CID 13199502

IUPACtrimethyl(oct-1-yn-3-yl)silane
SMILESC#CC(CCCCC)[Si](C)(C)C
InChIInChI=1S/C11H22Si/c1-6-8-9-10-11(7-2)12(3,4)5/h2,11H,6,8-10H2,1,3-5H3
InChIKeyOLBGACGBWUSRLB-UHFFFAOYSA-N
MW182.38 g/mol
LogP3.91
Rot. Bonds5

About trimethyl(oct-1-yn-3-yl)silane

trimethyl(oct-1-yn-3-yl)silane (PubChem CID 13199502) has the molecular formula C11H22Si and a molecular weight of 182.38 g/mol. Its IUPAC name is trimethyl(oct-1-yn-3-yl)silane.

Molecular Properties

Compound Nametrimethyl(oct-1-yn-3-yl)silane
PubChem CID13199502
Molecular FormulaC11H22Si
Molecular Weight182.38 g/mol
Exact Mass182.15
IUPAC Nametrimethyl(oct-1-yn-3-yl)silane
SMILESC#CC(CCCCC)[Si](C)(C)C
InChIInChI=1S/C11H22Si/c1-6-8-9-10-11(7-2)12(3,4)5/h2,11H,6,8-10H2,1,3-5H3
InChIKeyOLBGACGBWUSRLB-UHFFFAOYSA-N
XLogP3.91
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.38
LogP ≤ 53.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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

hept-1-yn-3-yl(trimethyl)silane
CID 13406629
hex-1-yn-3-yl(trimethyl)silane
CID 10464603
trimethyl-[(3R)-oct-1-yn-3-yl]oxysilane
CID 129404520
(3R)-3-methyloct-1-yne
CID 59216928
dec-1-yn-5-yl(trimethyl)silane
CID 174999059
4-ethynyldodecane
CID 15570330
bromomethyl-dimethyl-oct-1-yn-3-yloxysilane
CID 10333708
1,2,3,4,5-pentamethyl-6-oct-1-yn-3-ylbenzene
CID 173046007
3-ethoxyoct-1-yne
CID 20555693
dodecan-2-yl(trimethyl)silane
CID 11425039
trimethyl(non-1-yn-4-yloxy)silane
CID 10954874
oct-1-yn-3-yloxy-tri(propan-2-yl)silane
CID 10869775

Frequently Asked Questions

What is the IUPAC name of trimethyl(oct-1-yn-3-yl)silane?
The IUPAC name of trimethyl(oct-1-yn-3-yl)silane (CID 13199502) is trimethyl(oct-1-yn-3-yl)silane.
What is the SMILES notation for trimethyl(oct-1-yn-3-yl)silane?
The canonical SMILES for trimethyl(oct-1-yn-3-yl)silane is C#CC(CCCCC)[Si](C)(C)C.
What is the InChIKey of trimethyl(oct-1-yn-3-yl)silane?
The InChIKey is OLBGACGBWUSRLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22Si/c1-6-8-9-10-11(7-2)12(3,4)5/h2,11H,6,8-10H2,1,3-5H3.
What are the key properties of trimethyl(oct-1-yn-3-yl)silane?
trimethyl(oct-1-yn-3-yl)silane has a molecular weight of 182.38 g/mol, XLogP of 3.91, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl(oct-1-yn-3-yl)silane is sourced from PubChem (CID 13199502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).