1,1-dimethyl-3-(4-methylpent-3-enyl)-2,5-dihydrosilole

C12H22Si — CID 44597123

IUPAC1,1-dimethyl-3-(4-methylpent-3-enyl)-2,5-dihydrosilole
SMILESCC(C)=CCCC1=CC[Si](C)(C)C1
InChIInChI=1S/C12H22Si/c1-11(2)6-5-7-12-8-9-13(3,4)10-12/h6,8H,5,7,9-10H2,1-4H3
InChIKeyALDJNZSOZWFHFF-UHFFFAOYSA-N
MW194.39 g/mol
LogP4.38
Rot. Bonds3

About 1,1-dimethyl-3-(4-methylpent-3-enyl)-2,5-dihydrosilole

1,1-dimethyl-3-(4-methylpent-3-enyl)-2,5-dihydrosilole (PubChem CID 44597123) has the molecular formula C12H22Si and a molecular weight of 194.39 g/mol. Its IUPAC name is 1,1-dimethyl-3-(4-methylpent-3-enyl)-2,5-dihydrosilole.

Molecular Properties

Compound Name1,1-dimethyl-3-(4-methylpent-3-enyl)-2,5-dihydrosilole
PubChem CID44597123
Molecular FormulaC12H22Si
Molecular Weight194.39 g/mol
Exact Mass194.15
IUPAC Name1,1-dimethyl-3-(4-methylpent-3-enyl)-2,5-dihydrosilole
SMILESCC(C)=CCCC1=CC[Si](C)(C)C1
InChIInChI=1S/C12H22Si/c1-11(2)6-5-7-12-8-9-13(3,4)10-12/h6,8H,5,7,9-10H2,1-4H3
InChIKeyALDJNZSOZWFHFF-UHFFFAOYSA-N
XLogP4.38
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.39
LogP ≤ 54.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

Silane, cyclopentenyltrimethyl-
CID 580560
1-[2-(Trimethylsilyl)ethynyl]cyclopentene
CID 12778987
Silane, (1-cyclohexen-1-ylmethyl)trimethyl-
CID 10964921
Silane, (2-cyclohexylideneethyl)trimethyl-
CID 10976133
[(4E)-5,9-dimethyldeca-4,8-dien-1-ynyl]-trimethylsilane
CID 10354026
trimethyl-[(E)-oct-4-en-4-yl]silane
CID 10702656
((2E)-3,7-Dimethyl-2,6-octadien-1-yl)trimethylsilane
CID 10954825
[(E)-hept-2-enyl]-trimethylsilane
CID 13215151
[(Z)-hept-2-enyl]-trimethylsilane
CID 13215152
[(E)-2-(cyclopenten-1-yl)ethenyl]-trimethylsilane
CID 14175462
2-Heptenyltrimethylsilane
CID 85700091
[(2E)-5,6-dimethylhepta-2,5-dienyl]-trimethylsilane
CID 101546838

Frequently Asked Questions

What is the IUPAC name of 1,1-dimethyl-3-(4-methylpent-3-enyl)-2,5-dihydrosilole?
The IUPAC name of 1,1-dimethyl-3-(4-methylpent-3-enyl)-2,5-dihydrosilole (CID 44597123) is 1,1-dimethyl-3-(4-methylpent-3-enyl)-2,5-dihydrosilole.
What is the SMILES notation for 1,1-dimethyl-3-(4-methylpent-3-enyl)-2,5-dihydrosilole?
The canonical SMILES for 1,1-dimethyl-3-(4-methylpent-3-enyl)-2,5-dihydrosilole is CC(C)=CCCC1=CC[Si](C)(C)C1.
What is the InChIKey of 1,1-dimethyl-3-(4-methylpent-3-enyl)-2,5-dihydrosilole?
The InChIKey is ALDJNZSOZWFHFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22Si/c1-11(2)6-5-7-12-8-9-13(3,4)10-12/h6,8H,5,7,9-10H2,1-4H3.
What are the key properties of 1,1-dimethyl-3-(4-methylpent-3-enyl)-2,5-dihydrosilole?
1,1-dimethyl-3-(4-methylpent-3-enyl)-2,5-dihydrosilole has a molecular weight of 194.39 g/mol, XLogP of 4.38, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-dimethyl-3-(4-methylpent-3-enyl)-2,5-dihydrosilole is sourced from PubChem (CID 44597123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).