tert-butyl-dimethyl-[[(2R,5S)-4-methylidene-5-prop-2-enyloxolan-2-yl]methoxy]silane

C15H28O2Si — CID 71665048

IUPACtert-butyl-dimethyl-[[(2R,5S)-4-methylidene-5-prop-2-enyloxolan-2-yl]methoxy]silane
SMILESC=CC[C@@H]1O[C@@H](CO[Si](C)(C)C(C)(C)C)CC1=C
InChIInChI=1S/C15H28O2Si/c1-8-9-14-12(2)10-13(17-14)11-16-18(6,7)15(3,4)5/h8,13-14H,1-2,9-11H2,3-7H3/t13-,14+/m1/s1
InChIKeyQDYSOHLVIFIGKT-KGLIPLIRSA-N
MW268.47 g/mol
LogP4.30
Rot. Bonds5

About tert-butyl-dimethyl-[[(2R,5S)-4-methylidene-5-prop-2-enyloxolan-2-yl]methoxy]silane

tert-butyl-dimethyl-[[(2R,5S)-4-methylidene-5-prop-2-enyloxolan-2-yl]methoxy]silane (PubChem CID 71665048) has the molecular formula C15H28O2Si and a molecular weight of 268.47 g/mol. Its IUPAC name is tert-butyl-dimethyl-[[(2R,5S)-4-methylidene-5-prop-2-enyloxolan-2-yl]methoxy]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[[(2R,5S)-4-methylidene-5-prop-2-enyloxolan-2-yl]methoxy]silane
PubChem CID71665048
Molecular FormulaC15H28O2Si
Molecular Weight268.47 g/mol
Exact Mass268.19
IUPAC Nametert-butyl-dimethyl-[[(2R,5S)-4-methylidene-5-prop-2-enyloxolan-2-yl]methoxy]silane
SMILESC=CC[C@@H]1O[C@@H](CO[Si](C)(C)C(C)(C)C)CC1=C
InChIInChI=1S/C15H28O2Si/c1-8-9-14-12(2)10-13(17-14)11-16-18(6,7)15(3,4)5/h8,13-14H,1-2,9-11H2,3-7H3/t13-,14+/m1/s1
InChIKeyQDYSOHLVIFIGKT-KGLIPLIRSA-N
XLogP4.30
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
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'}

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Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[[(2R,5S)-4-methylidene-5-prop-2-enyloxolan-2-yl]methoxy]silane?
The IUPAC name of tert-butyl-dimethyl-[[(2R,5S)-4-methylidene-5-prop-2-enyloxolan-2-yl]methoxy]silane (CID 71665048) is tert-butyl-dimethyl-[[(2R,5S)-4-methylidene-5-prop-2-enyloxolan-2-yl]methoxy]silane.
What is the SMILES notation for tert-butyl-dimethyl-[[(2R,5S)-4-methylidene-5-prop-2-enyloxolan-2-yl]methoxy]silane?
The canonical SMILES for tert-butyl-dimethyl-[[(2R,5S)-4-methylidene-5-prop-2-enyloxolan-2-yl]methoxy]silane is C=CC[C@@H]1O[C@@H](CO[Si](C)(C)C(C)(C)C)CC1=C.
What is the InChIKey of tert-butyl-dimethyl-[[(2R,5S)-4-methylidene-5-prop-2-enyloxolan-2-yl]methoxy]silane?
The InChIKey is QDYSOHLVIFIGKT-KGLIPLIRSA-N. The full InChI is InChI=1S/C15H28O2Si/c1-8-9-14-12(2)10-13(17-14)11-16-18(6,7)15(3,4)5/h8,13-14H,1-2,9-11H2,3-7H3/t13-,14+/m1/s1.
What are the key properties of tert-butyl-dimethyl-[[(2R,5S)-4-methylidene-5-prop-2-enyloxolan-2-yl]methoxy]silane?
tert-butyl-dimethyl-[[(2R,5S)-4-methylidene-5-prop-2-enyloxolan-2-yl]methoxy]silane has a molecular weight of 268.47 g/mol, XLogP of 4.30, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[[(2R,5S)-4-methylidene-5-prop-2-enyloxolan-2-yl]methoxy]silane is sourced from PubChem (CID 71665048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).