2-[di(propan-2-yloxy)methyl]prop-2-enyl-trimethylsilane

C13H28O2Si — CID 10729016

IUPAC2-[di(propan-2-yloxy)methyl]prop-2-enyl-trimethylsilane
SMILESC=C(C[Si](C)(C)C)C(OC(C)C)OC(C)C
InChIInChI=1S/C13H28O2Si/c1-10(2)14-13(15-11(3)4)12(5)9-16(6,7)8/h10-11,13H,5,9H2,1-4,6-8H3
InChIKeyULNXSXBKGCEXTO-UHFFFAOYSA-N
MW244.45 g/mol
LogP4.06
Rot. Bonds7

About 2-[di(propan-2-yloxy)methyl]prop-2-enyl-trimethylsilane

2-[di(propan-2-yloxy)methyl]prop-2-enyl-trimethylsilane (PubChem CID 10729016) has the molecular formula C13H28O2Si and a molecular weight of 244.45 g/mol. Its IUPAC name is 2-[di(propan-2-yloxy)methyl]prop-2-enyl-trimethylsilane.

Molecular Properties

Compound Name2-[di(propan-2-yloxy)methyl]prop-2-enyl-trimethylsilane
PubChem CID10729016
Molecular FormulaC13H28O2Si
Molecular Weight244.45 g/mol
Exact Mass244.19
IUPAC Name2-[di(propan-2-yloxy)methyl]prop-2-enyl-trimethylsilane
SMILESC=C(C[Si](C)(C)C)C(OC(C)C)OC(C)C
InChIInChI=1S/C13H28O2Si/c1-10(2)14-13(15-11(3)4)12(5)9-16(6,7)8/h10-11,13H,5,9H2,1-4,6-8H3
InChIKeyULNXSXBKGCEXTO-UHFFFAOYSA-N
XLogP4.06
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.45
LogP ≤ 54.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[di(propan-2-yloxy)methyl]prop-2-enyl-trimethylsilane?
The IUPAC name of 2-[di(propan-2-yloxy)methyl]prop-2-enyl-trimethylsilane (CID 10729016) is 2-[di(propan-2-yloxy)methyl]prop-2-enyl-trimethylsilane.
What is the SMILES notation for 2-[di(propan-2-yloxy)methyl]prop-2-enyl-trimethylsilane?
The canonical SMILES for 2-[di(propan-2-yloxy)methyl]prop-2-enyl-trimethylsilane is C=C(C[Si](C)(C)C)C(OC(C)C)OC(C)C.
What is the InChIKey of 2-[di(propan-2-yloxy)methyl]prop-2-enyl-trimethylsilane?
The InChIKey is ULNXSXBKGCEXTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28O2Si/c1-10(2)14-13(15-11(3)4)12(5)9-16(6,7)8/h10-11,13H,5,9H2,1-4,6-8H3.
What are the key properties of 2-[di(propan-2-yloxy)methyl]prop-2-enyl-trimethylsilane?
2-[di(propan-2-yloxy)methyl]prop-2-enyl-trimethylsilane has a molecular weight of 244.45 g/mol, XLogP of 4.06, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[di(propan-2-yloxy)methyl]prop-2-enyl-trimethylsilane is sourced from PubChem (CID 10729016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).