[(2S)-2-(2-methoxyethyl)pent-4-enyl]-dimethyl-prop-2-enylsilane

C13H26OSi — CID 140886497

IUPAC[(2S)-2-(2-methoxyethyl)pent-4-enyl]-dimethyl-prop-2-enylsilane
SMILESC=CC[C@@H](CCOC)C[Si](C)(C)CC=C
InChIInChI=1S/C13H26OSi/c1-6-8-13(9-10-14-3)12-15(4,5)11-7-2/h6-7,13H,1-2,8-12H2,3-5H3/t13-/m0/s1
InChIKeyAVSJAEKMWKYGDW-ZDUSSCGKSA-N
MW226.44 g/mol
LogP4.11
Rot. Bonds9

About [(2S)-2-(2-methoxyethyl)pent-4-enyl]-dimethyl-prop-2-enylsilane

[(2S)-2-(2-methoxyethyl)pent-4-enyl]-dimethyl-prop-2-enylsilane (PubChem CID 140886497) has the molecular formula C13H26OSi and a molecular weight of 226.44 g/mol. Its IUPAC name is [(2S)-2-(2-methoxyethyl)pent-4-enyl]-dimethyl-prop-2-enylsilane.

Molecular Properties

Compound Name[(2S)-2-(2-methoxyethyl)pent-4-enyl]-dimethyl-prop-2-enylsilane
PubChem CID140886497
Molecular FormulaC13H26OSi
Molecular Weight226.44 g/mol
Exact Mass226.18
IUPAC Name[(2S)-2-(2-methoxyethyl)pent-4-enyl]-dimethyl-prop-2-enylsilane
SMILESC=CC[C@@H](CCOC)C[Si](C)(C)CC=C
InChIInChI=1S/C13H26OSi/c1-6-8-13(9-10-14-3)12-15(4,5)11-7-2/h6-7,13H,1-2,8-12H2,3-5H3/t13-/m0/s1
InChIKeyAVSJAEKMWKYGDW-ZDUSSCGKSA-N
XLogP4.11
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.44
LogP ≤ 54.11
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 [(2S)-2-(2-methoxyethyl)pent-4-enyl]-dimethyl-prop-2-enylsilane?
The IUPAC name of [(2S)-2-(2-methoxyethyl)pent-4-enyl]-dimethyl-prop-2-enylsilane (CID 140886497) is [(2S)-2-(2-methoxyethyl)pent-4-enyl]-dimethyl-prop-2-enylsilane.
What is the SMILES notation for [(2S)-2-(2-methoxyethyl)pent-4-enyl]-dimethyl-prop-2-enylsilane?
The canonical SMILES for [(2S)-2-(2-methoxyethyl)pent-4-enyl]-dimethyl-prop-2-enylsilane is C=CC[C@@H](CCOC)C[Si](C)(C)CC=C.
What is the InChIKey of [(2S)-2-(2-methoxyethyl)pent-4-enyl]-dimethyl-prop-2-enylsilane?
The InChIKey is AVSJAEKMWKYGDW-ZDUSSCGKSA-N. The full InChI is InChI=1S/C13H26OSi/c1-6-8-13(9-10-14-3)12-15(4,5)11-7-2/h6-7,13H,1-2,8-12H2,3-5H3/t13-/m0/s1.
What are the key properties of [(2S)-2-(2-methoxyethyl)pent-4-enyl]-dimethyl-prop-2-enylsilane?
[(2S)-2-(2-methoxyethyl)pent-4-enyl]-dimethyl-prop-2-enylsilane has a molecular weight of 226.44 g/mol, XLogP of 4.11, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S)-2-(2-methoxyethyl)pent-4-enyl]-dimethyl-prop-2-enylsilane is sourced from PubChem (CID 140886497), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).