tert-butyl-dimethyl-(2,2,5,5-tetramethylhept-6-en-3-yl)silane

C17H36Si — CID 123959029

IUPACtert-butyl-dimethyl-(2,2,5,5-tetramethylhept-6-en-3-yl)silane
SMILESC=CC(C)(C)CC(C(C)(C)C)[Si](C)(C)C(C)(C)C
InChIInChI=1S/C17H36Si/c1-12-17(8,9)13-14(15(2,3)4)18(10,11)16(5,6)7/h12,14H,1,13H2,2-11H3
InChIKeyFDAVBUNAYPXDEQ-UHFFFAOYSA-N
MW268.56 g/mol
LogP6.51
Rot. Bonds4

About tert-butyl-dimethyl-(2,2,5,5-tetramethylhept-6-en-3-yl)silane

tert-butyl-dimethyl-(2,2,5,5-tetramethylhept-6-en-3-yl)silane (PubChem CID 123959029) has the molecular formula C17H36Si and a molecular weight of 268.56 g/mol. Its IUPAC name is tert-butyl-dimethyl-(2,2,5,5-tetramethylhept-6-en-3-yl)silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-(2,2,5,5-tetramethylhept-6-en-3-yl)silane
PubChem CID123959029
Molecular FormulaC17H36Si
Molecular Weight268.56 g/mol
Exact Mass268.26
IUPAC Nametert-butyl-dimethyl-(2,2,5,5-tetramethylhept-6-en-3-yl)silane
SMILESC=CC(C)(C)CC(C(C)(C)C)[Si](C)(C)C(C)(C)C
InChIInChI=1S/C17H36Si/c1-12-17(8,9)13-14(15(2,3)4)18(10,11)16(5,6)7/h12,14H,1,13H2,2-11H3
InChIKeyFDAVBUNAYPXDEQ-UHFFFAOYSA-N
XLogP6.51
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500268.56
LogP ≤ 56.51
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-(2,2,5,5-tetramethylhept-6-en-3-yl)silane?
The IUPAC name of tert-butyl-dimethyl-(2,2,5,5-tetramethylhept-6-en-3-yl)silane (CID 123959029) is tert-butyl-dimethyl-(2,2,5,5-tetramethylhept-6-en-3-yl)silane.
What is the SMILES notation for tert-butyl-dimethyl-(2,2,5,5-tetramethylhept-6-en-3-yl)silane?
The canonical SMILES for tert-butyl-dimethyl-(2,2,5,5-tetramethylhept-6-en-3-yl)silane is C=CC(C)(C)CC(C(C)(C)C)[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-dimethyl-(2,2,5,5-tetramethylhept-6-en-3-yl)silane?
The InChIKey is FDAVBUNAYPXDEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H36Si/c1-12-17(8,9)13-14(15(2,3)4)18(10,11)16(5,6)7/h12,14H,1,13H2,2-11H3.
What are the key properties of tert-butyl-dimethyl-(2,2,5,5-tetramethylhept-6-en-3-yl)silane?
tert-butyl-dimethyl-(2,2,5,5-tetramethylhept-6-en-3-yl)silane has a molecular weight of 268.56 g/mol, XLogP of 6.51, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-(2,2,5,5-tetramethylhept-6-en-3-yl)silane is sourced from PubChem (CID 123959029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).