tert-butyl-dimethyl-(5-methyl-2-prop-1-en-2-ylhex-4-enoxy)silane

C16H32OSi — CID 14845988

IUPACtert-butyl-dimethyl-(5-methyl-2-prop-1-en-2-ylhex-4-enoxy)silane
SMILESC=C(C)C(CC=C(C)C)CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C16H32OSi/c1-13(2)10-11-15(14(3)4)12-17-18(8,9)16(5,6)7/h10,15H,3,11-12H2,1-2,4-9H3
InChIKeyVQWGHEHSOBPJJB-UHFFFAOYSA-N
MW268.52 g/mol
LogP5.56
Rot. Bonds6

About tert-butyl-dimethyl-(5-methyl-2-prop-1-en-2-ylhex-4-enoxy)silane

tert-butyl-dimethyl-(5-methyl-2-prop-1-en-2-ylhex-4-enoxy)silane (PubChem CID 14845988) has the molecular formula C16H32OSi and a molecular weight of 268.52 g/mol. Its IUPAC name is tert-butyl-dimethyl-(5-methyl-2-prop-1-en-2-ylhex-4-enoxy)silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-(5-methyl-2-prop-1-en-2-ylhex-4-enoxy)silane
PubChem CID14845988
Molecular FormulaC16H32OSi
Molecular Weight268.52 g/mol
Exact Mass268.22
IUPAC Nametert-butyl-dimethyl-(5-methyl-2-prop-1-en-2-ylhex-4-enoxy)silane
SMILESC=C(C)C(CC=C(C)C)CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C16H32OSi/c1-13(2)10-11-15(14(3)4)12-17-18(8,9)16(5,6)7/h10,15H,3,11-12H2,1-2,4-9H3
InChIKeyVQWGHEHSOBPJJB-UHFFFAOYSA-N
XLogP5.56
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500268.52
LogP ≤ 55.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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-(5-methyl-2-prop-1-en-2-ylhex-4-enoxy)silane?
The IUPAC name of tert-butyl-dimethyl-(5-methyl-2-prop-1-en-2-ylhex-4-enoxy)silane (CID 14845988) is tert-butyl-dimethyl-(5-methyl-2-prop-1-en-2-ylhex-4-enoxy)silane.
What is the SMILES notation for tert-butyl-dimethyl-(5-methyl-2-prop-1-en-2-ylhex-4-enoxy)silane?
The canonical SMILES for tert-butyl-dimethyl-(5-methyl-2-prop-1-en-2-ylhex-4-enoxy)silane is C=C(C)C(CC=C(C)C)CO[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-dimethyl-(5-methyl-2-prop-1-en-2-ylhex-4-enoxy)silane?
The InChIKey is VQWGHEHSOBPJJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32OSi/c1-13(2)10-11-15(14(3)4)12-17-18(8,9)16(5,6)7/h10,15H,3,11-12H2,1-2,4-9H3.
What are the key properties of tert-butyl-dimethyl-(5-methyl-2-prop-1-en-2-ylhex-4-enoxy)silane?
tert-butyl-dimethyl-(5-methyl-2-prop-1-en-2-ylhex-4-enoxy)silane has a molecular weight of 268.52 g/mol, XLogP of 5.56, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-(5-methyl-2-prop-1-en-2-ylhex-4-enoxy)silane is sourced from PubChem (CID 14845988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).