tert-butyl-dimethyl-(6-methylhept-1-enoxy)silane

C14H30OSi — CID 173250062

IUPACtert-butyl-dimethyl-(6-methylhept-1-enoxy)silane
SMILESCC(C)CCCC=CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C14H30OSi/c1-13(2)11-9-8-10-12-15-16(6,7)14(3,4)5/h10,12-13H,8-9,11H2,1-7H3
InChIKeyOEPMYZSLJMCJHX-UHFFFAOYSA-N
MW242.48 g/mol
LogP5.35
Rot. Bonds6

About tert-butyl-dimethyl-(6-methylhept-1-enoxy)silane

tert-butyl-dimethyl-(6-methylhept-1-enoxy)silane (PubChem CID 173250062) has the molecular formula C14H30OSi and a molecular weight of 242.48 g/mol. Its IUPAC name is tert-butyl-dimethyl-(6-methylhept-1-enoxy)silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-(6-methylhept-1-enoxy)silane
PubChem CID173250062
Molecular FormulaC14H30OSi
Molecular Weight242.48 g/mol
Exact Mass242.21
IUPAC Nametert-butyl-dimethyl-(6-methylhept-1-enoxy)silane
SMILESCC(C)CCCC=CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C14H30OSi/c1-13(2)11-9-8-10-12-15-16(6,7)14(3,4)5/h10,12-13H,8-9,11H2,1-7H3
InChIKeyOEPMYZSLJMCJHX-UHFFFAOYSA-N
XLogP5.35
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500242.48
LogP ≤ 55.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-(6-methylhept-1-enoxy)silane?
The IUPAC name of tert-butyl-dimethyl-(6-methylhept-1-enoxy)silane (CID 173250062) is tert-butyl-dimethyl-(6-methylhept-1-enoxy)silane.
What is the SMILES notation for tert-butyl-dimethyl-(6-methylhept-1-enoxy)silane?
The canonical SMILES for tert-butyl-dimethyl-(6-methylhept-1-enoxy)silane is CC(C)CCCC=CO[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-dimethyl-(6-methylhept-1-enoxy)silane?
The InChIKey is OEPMYZSLJMCJHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30OSi/c1-13(2)11-9-8-10-12-15-16(6,7)14(3,4)5/h10,12-13H,8-9,11H2,1-7H3.
What are the key properties of tert-butyl-dimethyl-(6-methylhept-1-enoxy)silane?
tert-butyl-dimethyl-(6-methylhept-1-enoxy)silane has a molecular weight of 242.48 g/mol, XLogP of 5.35, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-(6-methylhept-1-enoxy)silane is sourced from PubChem (CID 173250062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).