trimethyl-[2-[(2R,4S,5S)-4-methyl-5-prop-2-enyloxolan-2-yl]oxyethyl]silane

C13H26O2Si — CID 11172557

IUPACtrimethyl-[2-[(2R,4S,5S)-4-methyl-5-prop-2-enyloxolan-2-yl]oxyethyl]silane
SMILESC=CC[C@@H]1O[C@@H](OCC[Si](C)(C)C)C[C@@H]1C
InChIInChI=1S/C13H26O2Si/c1-6-7-12-11(2)10-13(15-12)14-8-9-16(3,4)5/h6,11-13H,1,7-10H2,2-5H3/t11-,12-,13+/m0/s1
InChIKeyIXILLNFVZCQKQF-RWMBFGLXSA-N
MW242.43 g/mol
LogP3.67
Rot. Bonds6

About trimethyl-[2-[(2R,4S,5S)-4-methyl-5-prop-2-enyloxolan-2-yl]oxyethyl]silane

trimethyl-[2-[(2R,4S,5S)-4-methyl-5-prop-2-enyloxolan-2-yl]oxyethyl]silane (PubChem CID 11172557) has the molecular formula C13H26O2Si and a molecular weight of 242.43 g/mol. Its IUPAC name is trimethyl-[2-[(2R,4S,5S)-4-methyl-5-prop-2-enyloxolan-2-yl]oxyethyl]silane.

Molecular Properties

Compound Nametrimethyl-[2-[(2R,4S,5S)-4-methyl-5-prop-2-enyloxolan-2-yl]oxyethyl]silane
PubChem CID11172557
Molecular FormulaC13H26O2Si
Molecular Weight242.43 g/mol
Exact Mass242.17
IUPAC Nametrimethyl-[2-[(2R,4S,5S)-4-methyl-5-prop-2-enyloxolan-2-yl]oxyethyl]silane
SMILESC=CC[C@@H]1O[C@@H](OCC[Si](C)(C)C)C[C@@H]1C
InChIInChI=1S/C13H26O2Si/c1-6-7-12-11(2)10-13(15-12)14-8-9-16(3,4)5/h6,11-13H,1,7-10H2,2-5H3/t11-,12-,13+/m0/s1
InChIKeyIXILLNFVZCQKQF-RWMBFGLXSA-N
XLogP3.67
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.43
LogP ≤ 53.67
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 trimethyl-[2-[(2R,4S,5S)-4-methyl-5-prop-2-enyloxolan-2-yl]oxyethyl]silane?
The IUPAC name of trimethyl-[2-[(2R,4S,5S)-4-methyl-5-prop-2-enyloxolan-2-yl]oxyethyl]silane (CID 11172557) is trimethyl-[2-[(2R,4S,5S)-4-methyl-5-prop-2-enyloxolan-2-yl]oxyethyl]silane.
What is the SMILES notation for trimethyl-[2-[(2R,4S,5S)-4-methyl-5-prop-2-enyloxolan-2-yl]oxyethyl]silane?
The canonical SMILES for trimethyl-[2-[(2R,4S,5S)-4-methyl-5-prop-2-enyloxolan-2-yl]oxyethyl]silane is C=CC[C@@H]1O[C@@H](OCC[Si](C)(C)C)C[C@@H]1C.
What is the InChIKey of trimethyl-[2-[(2R,4S,5S)-4-methyl-5-prop-2-enyloxolan-2-yl]oxyethyl]silane?
The InChIKey is IXILLNFVZCQKQF-RWMBFGLXSA-N. The full InChI is InChI=1S/C13H26O2Si/c1-6-7-12-11(2)10-13(15-12)14-8-9-16(3,4)5/h6,11-13H,1,7-10H2,2-5H3/t11-,12-,13+/m0/s1.
What are the key properties of trimethyl-[2-[(2R,4S,5S)-4-methyl-5-prop-2-enyloxolan-2-yl]oxyethyl]silane?
trimethyl-[2-[(2R,4S,5S)-4-methyl-5-prop-2-enyloxolan-2-yl]oxyethyl]silane has a molecular weight of 242.43 g/mol, XLogP of 3.67, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[2-[(2R,4S,5S)-4-methyl-5-prop-2-enyloxolan-2-yl]oxyethyl]silane is sourced from PubChem (CID 11172557), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).