hexa-3,4-dien-1-ynyl(trimethyl)silane

C9H14Si — CID 12670020

IUPAChexa-3,4-dien-1-ynyl(trimethyl)silane
SMILESCC=C=CC#C[Si](C)(C)C
InChIInChI=1S/C9H14Si/c1-5-6-7-8-9-10(2,3)4/h5,7H,1-4H3
InChIKeyPAAMRVRTBLFVGT-UHFFFAOYSA-N
MW150.30 g/mol
LogP2.60
Rot. Bonds

About hexa-3,4-dien-1-ynyl(trimethyl)silane

hexa-3,4-dien-1-ynyl(trimethyl)silane (PubChem CID 12670020) has the molecular formula C9H14Si and a molecular weight of 150.30 g/mol. Its IUPAC name is hexa-3,4-dien-1-ynyl(trimethyl)silane.

Molecular Properties

Compound Namehexa-3,4-dien-1-ynyl(trimethyl)silane
PubChem CID12670020
Molecular FormulaC9H14Si
Molecular Weight150.30 g/mol
Exact Mass150.09
IUPAC Namehexa-3,4-dien-1-ynyl(trimethyl)silane
SMILESCC=C=CC#C[Si](C)(C)C
InChIInChI=1S/C9H14Si/c1-5-6-7-8-9-10(2,3)4/h5,7H,1-4H3
InChIKeyPAAMRVRTBLFVGT-UHFFFAOYSA-N
XLogP2.60
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.30
LogP ≤ 52.60
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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Frequently Asked Questions

What is the IUPAC name of hexa-3,4-dien-1-ynyl(trimethyl)silane?
The IUPAC name of hexa-3,4-dien-1-ynyl(trimethyl)silane (CID 12670020) is hexa-3,4-dien-1-ynyl(trimethyl)silane.
What is the SMILES notation for hexa-3,4-dien-1-ynyl(trimethyl)silane?
The canonical SMILES for hexa-3,4-dien-1-ynyl(trimethyl)silane is CC=C=CC#C[Si](C)(C)C.
What is the InChIKey of hexa-3,4-dien-1-ynyl(trimethyl)silane?
The InChIKey is PAAMRVRTBLFVGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14Si/c1-5-6-7-8-9-10(2,3)4/h5,7H,1-4H3.
What are the key properties of hexa-3,4-dien-1-ynyl(trimethyl)silane?
hexa-3,4-dien-1-ynyl(trimethyl)silane has a molecular weight of 150.30 g/mol, XLogP of 2.60, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for hexa-3,4-dien-1-ynyl(trimethyl)silane is sourced from PubChem (CID 12670020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).