tert-butyl-[(2R)-2-methoxypent-4-enoxy]-dimethylsilane

C12H26O2Si — CID 24806490

IUPACtert-butyl-[(2R)-2-methoxypent-4-enoxy]-dimethylsilane
SMILESC=CC[C@H](CO[Si](C)(C)C(C)(C)C)OC
InChIInChI=1S/C12H26O2Si/c1-8-9-11(13-5)10-14-15(6,7)12(2,3)4/h8,11H,1,9-10H2,2-7H3/t11-/m1/s1
InChIKeyJNQPXOVCGXLNFM-LLVKDONJSA-N
MW230.42 g/mol
LogP3.60
Rot. Bonds6

About tert-butyl-[(2R)-2-methoxypent-4-enoxy]-dimethylsilane

tert-butyl-[(2R)-2-methoxypent-4-enoxy]-dimethylsilane (PubChem CID 24806490) has the molecular formula C12H26O2Si and a molecular weight of 230.42 g/mol. Its IUPAC name is tert-butyl-[(2R)-2-methoxypent-4-enoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[(2R)-2-methoxypent-4-enoxy]-dimethylsilane
PubChem CID24806490
Molecular FormulaC12H26O2Si
Molecular Weight230.42 g/mol
Exact Mass230.17
IUPAC Nametert-butyl-[(2R)-2-methoxypent-4-enoxy]-dimethylsilane
SMILESC=CC[C@H](CO[Si](C)(C)C(C)(C)C)OC
InChIInChI=1S/C12H26O2Si/c1-8-9-11(13-5)10-14-15(6,7)12(2,3)4/h8,11H,1,9-10H2,2-7H3/t11-/m1/s1
InChIKeyJNQPXOVCGXLNFM-LLVKDONJSA-N
XLogP3.60
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.42
LogP ≤ 53.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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-[(2R)-2-methoxypent-4-enoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[(2R)-2-methoxypent-4-enoxy]-dimethylsilane (CID 24806490) is tert-butyl-[(2R)-2-methoxypent-4-enoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[(2R)-2-methoxypent-4-enoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[(2R)-2-methoxypent-4-enoxy]-dimethylsilane is C=CC[C@H](CO[Si](C)(C)C(C)(C)C)OC.
What is the InChIKey of tert-butyl-[(2R)-2-methoxypent-4-enoxy]-dimethylsilane?
The InChIKey is JNQPXOVCGXLNFM-LLVKDONJSA-N. The full InChI is InChI=1S/C12H26O2Si/c1-8-9-11(13-5)10-14-15(6,7)12(2,3)4/h8,11H,1,9-10H2,2-7H3/t11-/m1/s1.
What are the key properties of tert-butyl-[(2R)-2-methoxypent-4-enoxy]-dimethylsilane?
tert-butyl-[(2R)-2-methoxypent-4-enoxy]-dimethylsilane has a molecular weight of 230.42 g/mol, XLogP of 3.60, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(2R)-2-methoxypent-4-enoxy]-dimethylsilane is sourced from PubChem (CID 24806490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).