methylsilane;penta-1,3-diene

C6H14Si — CID 157171521

IUPACmethylsilane;penta-1,3-diene
SMILESC=CC=CC.C[SiH3]
InChIInChI=1S/C5H8.CH6Si/c1-3-5-4-2;1-2/h3-5H,1H2,2H3;1-2H3
InChIKeyANNGENWHXQISDF-UHFFFAOYSA-N
MW114.26 g/mol
LogP1.15
Rot. Bonds1

About methylsilane;penta-1,3-diene

methylsilane;penta-1,3-diene (PubChem CID 157171521) has the molecular formula C6H14Si and a molecular weight of 114.26 g/mol. Its IUPAC name is methylsilane;penta-1,3-diene.

Molecular Properties

Compound Namemethylsilane;penta-1,3-diene
PubChem CID157171521
Molecular FormulaC6H14Si
Molecular Weight114.26 g/mol
Exact Mass114.09
IUPAC Namemethylsilane;penta-1,3-diene
SMILESC=CC=CC.C[SiH3]
InChIInChI=1S/C5H8.CH6Si/c1-3-5-4-2;1-2/h3-5H,1H2,2H3;1-2H3
InChIKeyANNGENWHXQISDF-UHFFFAOYSA-N
XLogP1.15
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.26
LogP ≤ 51.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

But-2-enylsilane
CID 123303237
Penta-2,4-dienylsilane
CID 123979913
Pentadienylsilane
CID 129703134
1-Methyl-1,2-dihydrosiline
CID 71401601
CID 54150502
CID 54150502
But-2-enylidenesilane
CID 123293235
1,2-dimethyl-1H-silole
CID 123302003
Dimethyl(penta-1,3-dienyl)silane
CID 123495879
Methyl(penta-1,3-dienyl)silane
CID 123781139
Hepta-1,3,5-trien-2-ylsilane
CID 123889240
Penta-1,3-dienylsilane
CID 149252410
Chloro(penta-1,3-dienyl)silane
CID 149734635

Frequently Asked Questions

What is the IUPAC name of methylsilane;penta-1,3-diene?
The IUPAC name of methylsilane;penta-1,3-diene (CID 157171521) is methylsilane;penta-1,3-diene.
What is the SMILES notation for methylsilane;penta-1,3-diene?
The canonical SMILES for methylsilane;penta-1,3-diene is C=CC=CC.C[SiH3].
What is the InChIKey of methylsilane;penta-1,3-diene?
The InChIKey is ANNGENWHXQISDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8.CH6Si/c1-3-5-4-2;1-2/h3-5H,1H2,2H3;1-2H3.
What are the key properties of methylsilane;penta-1,3-diene?
methylsilane;penta-1,3-diene has a molecular weight of 114.26 g/mol, XLogP of 1.15, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for methylsilane;penta-1,3-diene is sourced from PubChem (CID 157171521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).