triethyl-[(1S)-1-[(2R)-2-(2-methylprop-2-enyl)oxiran-2-yl]prop-2-enoxy]silane

C15H28O2Si — CID 11437111

IUPACtriethyl-[(1S)-1-[(2R)-2-(2-methylprop-2-enyl)oxiran-2-yl]prop-2-enoxy]silane
SMILESC=C[C@H](O[Si](CC)(CC)CC)[C@@]1(CC(=C)C)CO1
InChIInChI=1S/C15H28O2Si/c1-7-14(15(12-16-15)11-13(5)6)17-18(8-2,9-3)10-4/h7,14H,1,5,8-12H2,2-4,6H3/t14-,15+/m0/s1
InChIKeyMQSKUMQUYBKIGX-LSDHHAIUSA-N
MW268.47 g/mol
LogP4.30
Rot. Bonds9

About triethyl-[(1S)-1-[(2R)-2-(2-methylprop-2-enyl)oxiran-2-yl]prop-2-enoxy]silane

triethyl-[(1S)-1-[(2R)-2-(2-methylprop-2-enyl)oxiran-2-yl]prop-2-enoxy]silane (PubChem CID 11437111) has the molecular formula C15H28O2Si and a molecular weight of 268.47 g/mol. Its IUPAC name is triethyl-[(1S)-1-[(2R)-2-(2-methylprop-2-enyl)oxiran-2-yl]prop-2-enoxy]silane.

Molecular Properties

Compound Nametriethyl-[(1S)-1-[(2R)-2-(2-methylprop-2-enyl)oxiran-2-yl]prop-2-enoxy]silane
PubChem CID11437111
Molecular FormulaC15H28O2Si
Molecular Weight268.47 g/mol
Exact Mass268.19
IUPAC Nametriethyl-[(1S)-1-[(2R)-2-(2-methylprop-2-enyl)oxiran-2-yl]prop-2-enoxy]silane
SMILESC=C[C@H](O[Si](CC)(CC)CC)[C@@]1(CC(=C)C)CO1
InChIInChI=1S/C15H28O2Si/c1-7-14(15(12-16-15)11-13(5)6)17-18(8-2,9-3)10-4/h7,14H,1,5,8-12H2,2-4,6H3/t14-,15+/m0/s1
InChIKeyMQSKUMQUYBKIGX-LSDHHAIUSA-N
XLogP4.30
TPSA21.76 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.47
LogP ≤ 54.30
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'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of triethyl-[(1S)-1-[(2R)-2-(2-methylprop-2-enyl)oxiran-2-yl]prop-2-enoxy]silane?
The IUPAC name of triethyl-[(1S)-1-[(2R)-2-(2-methylprop-2-enyl)oxiran-2-yl]prop-2-enoxy]silane (CID 11437111) is triethyl-[(1S)-1-[(2R)-2-(2-methylprop-2-enyl)oxiran-2-yl]prop-2-enoxy]silane.
What is the SMILES notation for triethyl-[(1S)-1-[(2R)-2-(2-methylprop-2-enyl)oxiran-2-yl]prop-2-enoxy]silane?
The canonical SMILES for triethyl-[(1S)-1-[(2R)-2-(2-methylprop-2-enyl)oxiran-2-yl]prop-2-enoxy]silane is C=C[C@H](O[Si](CC)(CC)CC)[C@@]1(CC(=C)C)CO1.
What is the InChIKey of triethyl-[(1S)-1-[(2R)-2-(2-methylprop-2-enyl)oxiran-2-yl]prop-2-enoxy]silane?
The InChIKey is MQSKUMQUYBKIGX-LSDHHAIUSA-N. The full InChI is InChI=1S/C15H28O2Si/c1-7-14(15(12-16-15)11-13(5)6)17-18(8-2,9-3)10-4/h7,14H,1,5,8-12H2,2-4,6H3/t14-,15+/m0/s1.
What are the key properties of triethyl-[(1S)-1-[(2R)-2-(2-methylprop-2-enyl)oxiran-2-yl]prop-2-enoxy]silane?
triethyl-[(1S)-1-[(2R)-2-(2-methylprop-2-enyl)oxiran-2-yl]prop-2-enoxy]silane has a molecular weight of 268.47 g/mol, XLogP of 4.30, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl-[(1S)-1-[(2R)-2-(2-methylprop-2-enyl)oxiran-2-yl]prop-2-enoxy]silane is sourced from PubChem (CID 11437111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).