tert-butyl-dimethyl-[(2R)-4-(2-prop-2-enyl-1,3-dioxolan-2-yl)butan-2-yl]oxysilane

C16H32O3Si — CID 135039837

IUPACtert-butyl-dimethyl-[(2R)-4-(2-prop-2-enyl-1,3-dioxolan-2-yl)butan-2-yl]oxysilane
SMILESC=CCC1(CC[C@@H](C)O[Si](C)(C)C(C)(C)C)OCCO1
InChIInChI=1S/C16H32O3Si/c1-8-10-16(17-12-13-18-16)11-9-14(2)19-20(6,7)15(3,4)5/h8,14H,1,9-13H2,2-7H3/t14-/m1/s1
InChIKeyJILOYBJAEUGGEO-CQSZACIVSA-N
MW300.52 g/mol
LogP4.50
Rot. Bonds7

About tert-butyl-dimethyl-[(2R)-4-(2-prop-2-enyl-1,3-dioxolan-2-yl)butan-2-yl]oxysilane

tert-butyl-dimethyl-[(2R)-4-(2-prop-2-enyl-1,3-dioxolan-2-yl)butan-2-yl]oxysilane (PubChem CID 135039837) has the molecular formula C16H32O3Si and a molecular weight of 300.52 g/mol. Its IUPAC name is tert-butyl-dimethyl-[(2R)-4-(2-prop-2-enyl-1,3-dioxolan-2-yl)butan-2-yl]oxysilane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[(2R)-4-(2-prop-2-enyl-1,3-dioxolan-2-yl)butan-2-yl]oxysilane
PubChem CID135039837
Molecular FormulaC16H32O3Si
Molecular Weight300.52 g/mol
Exact Mass300.21
IUPAC Nametert-butyl-dimethyl-[(2R)-4-(2-prop-2-enyl-1,3-dioxolan-2-yl)butan-2-yl]oxysilane
SMILESC=CCC1(CC[C@@H](C)O[Si](C)(C)C(C)(C)C)OCCO1
InChIInChI=1S/C16H32O3Si/c1-8-10-16(17-12-13-18-16)11-9-14(2)19-20(6,7)15(3,4)5/h8,14H,1,9-13H2,2-7H3/t14-/m1/s1
InChIKeyJILOYBJAEUGGEO-CQSZACIVSA-N
XLogP4.50
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.52
LogP ≤ 54.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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)-4-(2-prop-2-enyl-1,3-dioxolan-2-yl)butan-2-yl]oxysilane?
The IUPAC name of tert-butyl-dimethyl-[(2R)-4-(2-prop-2-enyl-1,3-dioxolan-2-yl)butan-2-yl]oxysilane (CID 135039837) is tert-butyl-dimethyl-[(2R)-4-(2-prop-2-enyl-1,3-dioxolan-2-yl)butan-2-yl]oxysilane.
What is the SMILES notation for tert-butyl-dimethyl-[(2R)-4-(2-prop-2-enyl-1,3-dioxolan-2-yl)butan-2-yl]oxysilane?
The canonical SMILES for tert-butyl-dimethyl-[(2R)-4-(2-prop-2-enyl-1,3-dioxolan-2-yl)butan-2-yl]oxysilane is C=CCC1(CC[C@@H](C)O[Si](C)(C)C(C)(C)C)OCCO1.
What is the InChIKey of tert-butyl-dimethyl-[(2R)-4-(2-prop-2-enyl-1,3-dioxolan-2-yl)butan-2-yl]oxysilane?
The InChIKey is JILOYBJAEUGGEO-CQSZACIVSA-N. The full InChI is InChI=1S/C16H32O3Si/c1-8-10-16(17-12-13-18-16)11-9-14(2)19-20(6,7)15(3,4)5/h8,14H,1,9-13H2,2-7H3/t14-/m1/s1.
What are the key properties of tert-butyl-dimethyl-[(2R)-4-(2-prop-2-enyl-1,3-dioxolan-2-yl)butan-2-yl]oxysilane?
tert-butyl-dimethyl-[(2R)-4-(2-prop-2-enyl-1,3-dioxolan-2-yl)butan-2-yl]oxysilane has a molecular weight of 300.52 g/mol, XLogP of 4.50, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[(2R)-4-(2-prop-2-enyl-1,3-dioxolan-2-yl)butan-2-yl]oxysilane is sourced from PubChem (CID 135039837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).