tert-butyl-[(E)-hex-2-enoxy]-dimethylsilane

C12H26OSi — CID 10987644

IUPACtert-butyl-[(E)-hex-2-enoxy]-dimethylsilane
SMILESCCC/C=C/CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C12H26OSi/c1-7-8-9-10-11-13-14(5,6)12(2,3)4/h9-10H,7-8,11H2,1-6H3/b10-9+
InChIKeyMQFOBDJOQKRVRW-MDZDMXLPSA-N
MW214.42 g/mol
LogP4.36
Rot. Bonds5

About tert-butyl-[(E)-hex-2-enoxy]-dimethylsilane

tert-butyl-[(E)-hex-2-enoxy]-dimethylsilane (PubChem CID 10987644) has the molecular formula C12H26OSi and a molecular weight of 214.42 g/mol. Its IUPAC name is tert-butyl-[(E)-hex-2-enoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[(E)-hex-2-enoxy]-dimethylsilane
PubChem CID10987644
Molecular FormulaC12H26OSi
Molecular Weight214.42 g/mol
Exact Mass214.18
IUPAC Nametert-butyl-[(E)-hex-2-enoxy]-dimethylsilane
SMILESCCC/C=C/CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C12H26OSi/c1-7-8-9-10-11-13-14(5,6)12(2,3)4/h9-10H,7-8,11H2,1-6H3/b10-9+
InChIKeyMQFOBDJOQKRVRW-MDZDMXLPSA-N
XLogP4.36
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.42
LogP ≤ 54.36
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-[(E)-hex-2-enoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[(E)-hex-2-enoxy]-dimethylsilane (CID 10987644) is tert-butyl-[(E)-hex-2-enoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[(E)-hex-2-enoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[(E)-hex-2-enoxy]-dimethylsilane is CCC/C=C/CO[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-[(E)-hex-2-enoxy]-dimethylsilane?
The InChIKey is MQFOBDJOQKRVRW-MDZDMXLPSA-N. The full InChI is InChI=1S/C12H26OSi/c1-7-8-9-10-11-13-14(5,6)12(2,3)4/h9-10H,7-8,11H2,1-6H3/b10-9+.
What are the key properties of tert-butyl-[(E)-hex-2-enoxy]-dimethylsilane?
tert-butyl-[(E)-hex-2-enoxy]-dimethylsilane has a molecular weight of 214.42 g/mol, XLogP of 4.36, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(E)-hex-2-enoxy]-dimethylsilane is sourced from PubChem (CID 10987644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).