triethyl-[6-(2-trimethylsilylcyclopropen-1-yl)hexa-1,3-diynyl]silane

C18H30Si2 — CID 134997996

IUPACtriethyl-[6-(2-trimethylsilylcyclopropen-1-yl)hexa-1,3-diynyl]silane
SMILESCC[Si](C#CC#CCCC1=C([Si](C)(C)C)C1)(CC)CC
InChIInChI=1S/C18H30Si2/c1-7-20(8-2,9-3)15-13-11-10-12-14-17-16-18(17)19(4,5)6/h7-9,12,14,16H2,1-6H3
InChIKeyKVPBFDBQQVQPLO-UHFFFAOYSA-N
MW302.61 g/mol
LogP5.40
Rot. Bonds6

About triethyl-[6-(2-trimethylsilylcyclopropen-1-yl)hexa-1,3-diynyl]silane

triethyl-[6-(2-trimethylsilylcyclopropen-1-yl)hexa-1,3-diynyl]silane (PubChem CID 134997996) has the molecular formula C18H30Si2 and a molecular weight of 302.61 g/mol. Its IUPAC name is triethyl-[6-(2-trimethylsilylcyclopropen-1-yl)hexa-1,3-diynyl]silane.

Molecular Properties

Compound Nametriethyl-[6-(2-trimethylsilylcyclopropen-1-yl)hexa-1,3-diynyl]silane
PubChem CID134997996
Molecular FormulaC18H30Si2
Molecular Weight302.61 g/mol
Exact Mass302.19
IUPAC Nametriethyl-[6-(2-trimethylsilylcyclopropen-1-yl)hexa-1,3-diynyl]silane
SMILESCC[Si](C#CC#CCCC1=C([Si](C)(C)C)C1)(CC)CC
InChIInChI=1S/C18H30Si2/c1-7-20(8-2,9-3)15-13-11-10-12-14-17-16-18(17)19(4,5)6/h7-9,12,14,16H2,1-6H3
InChIKeyKVPBFDBQQVQPLO-UHFFFAOYSA-N
XLogP5.40
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500302.61
LogP ≤ 55.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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

1-Trimethylsilyl-2-propylcyclopropene
CID 13509988
[3-[4-[1,5-Bis(trimethylsilyl)penta-1,4-diyn-3-ylidene]cyclohexylidene]-5-trimethylsilylpenta-1,4-diynyl]-trimethylsilane
CID 15363827
trimethyl-[(2E,6E)-2,3,6,7-tetramethyl-8-trimethylsilylocta-2,6-dienyl]silane
CID 23630571
Trimethyl-(2-prop-1-ynylcyclopenten-1-yl)silane
CID 91164749
trimethyl-[(E)-3-propyl-4-trimethylsilyloct-3-en-1-ynyl]silane
CID 134963826
trimethyl-[(E)-4-methyl-3-propan-2-yloct-3-en-1-ynyl]silane
CID 134977780
Triethyl-[5-(2-trimethylsilylcyclopropen-1-yl)pent-1-ynyl]silane
CID 164665543
trimethyl-[2-[(1Z,5Z)-2,5,6-tris(2-trimethylsilylethynyl)cycloocta-1,5-dien-1-yl]ethynyl]silane
CID 15266021
[(Z)-3-butyl-4-ethyldec-3-en-1,5-diynyl]-trimethylsilane
CID 10017015
trimethyl-[(E)-3-methyl-8-trimethylsilyloct-2-en-7-ynyl]silane
CID 10515932
(3-Cyclohexylidene-5-trimethylsilylpenta-1,4-diynyl)-trimethylsilane
CID 10684806
Trimethyl-[2-(2-prop-1-ynylcyclopenten-1-yl)ethynyl]silane
CID 11447020

Frequently Asked Questions

What is the IUPAC name of triethyl-[6-(2-trimethylsilylcyclopropen-1-yl)hexa-1,3-diynyl]silane?
The IUPAC name of triethyl-[6-(2-trimethylsilylcyclopropen-1-yl)hexa-1,3-diynyl]silane (CID 134997996) is triethyl-[6-(2-trimethylsilylcyclopropen-1-yl)hexa-1,3-diynyl]silane.
What is the SMILES notation for triethyl-[6-(2-trimethylsilylcyclopropen-1-yl)hexa-1,3-diynyl]silane?
The canonical SMILES for triethyl-[6-(2-trimethylsilylcyclopropen-1-yl)hexa-1,3-diynyl]silane is CC[Si](C#CC#CCCC1=C([Si](C)(C)C)C1)(CC)CC.
What is the InChIKey of triethyl-[6-(2-trimethylsilylcyclopropen-1-yl)hexa-1,3-diynyl]silane?
The InChIKey is KVPBFDBQQVQPLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30Si2/c1-7-20(8-2,9-3)15-13-11-10-12-14-17-16-18(17)19(4,5)6/h7-9,12,14,16H2,1-6H3.
What are the key properties of triethyl-[6-(2-trimethylsilylcyclopropen-1-yl)hexa-1,3-diynyl]silane?
triethyl-[6-(2-trimethylsilylcyclopropen-1-yl)hexa-1,3-diynyl]silane has a molecular weight of 302.61 g/mol, XLogP of 5.40, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl-[6-(2-trimethylsilylcyclopropen-1-yl)hexa-1,3-diynyl]silane is sourced from PubChem (CID 134997996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).