tert-butyl-dimethyl-(3-methylpent-1-en-3-yl)silane

C12H26Si — CID 135080550

IUPACtert-butyl-dimethyl-(3-methylpent-1-en-3-yl)silane
SMILESC=CC(C)(CC)[Si](C)(C)C(C)(C)C
InChIInChI=1S/C12H26Si/c1-9-12(6,10-2)13(7,8)11(3,4)5/h9H,1,10H2,2-8H3
InChIKeyDQJLUEBBXXBOHS-UHFFFAOYSA-N
MW198.43 g/mol
LogP4.85
Rot. Bonds3

About tert-butyl-dimethyl-(3-methylpent-1-en-3-yl)silane

tert-butyl-dimethyl-(3-methylpent-1-en-3-yl)silane (PubChem CID 135080550) has the molecular formula C12H26Si and a molecular weight of 198.43 g/mol. Its IUPAC name is tert-butyl-dimethyl-(3-methylpent-1-en-3-yl)silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-(3-methylpent-1-en-3-yl)silane
PubChem CID135080550
Molecular FormulaC12H26Si
Molecular Weight198.43 g/mol
Exact Mass198.18
IUPAC Nametert-butyl-dimethyl-(3-methylpent-1-en-3-yl)silane
SMILESC=CC(C)(CC)[Si](C)(C)C(C)(C)C
InChIInChI=1S/C12H26Si/c1-9-12(6,10-2)13(7,8)11(3,4)5/h9H,1,10H2,2-8H3
InChIKeyDQJLUEBBXXBOHS-UHFFFAOYSA-N
XLogP4.85
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.43
LogP ≤ 54.85
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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Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-(3-methylpent-1-en-3-yl)silane?
The IUPAC name of tert-butyl-dimethyl-(3-methylpent-1-en-3-yl)silane (CID 135080550) is tert-butyl-dimethyl-(3-methylpent-1-en-3-yl)silane.
What is the SMILES notation for tert-butyl-dimethyl-(3-methylpent-1-en-3-yl)silane?
The canonical SMILES for tert-butyl-dimethyl-(3-methylpent-1-en-3-yl)silane is C=CC(C)(CC)[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-dimethyl-(3-methylpent-1-en-3-yl)silane?
The InChIKey is DQJLUEBBXXBOHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26Si/c1-9-12(6,10-2)13(7,8)11(3,4)5/h9H,1,10H2,2-8H3.
What are the key properties of tert-butyl-dimethyl-(3-methylpent-1-en-3-yl)silane?
tert-butyl-dimethyl-(3-methylpent-1-en-3-yl)silane has a molecular weight of 198.43 g/mol, XLogP of 4.85, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-(3-methylpent-1-en-3-yl)silane is sourced from PubChem (CID 135080550), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).