tert-butyl-[[(4R,5R)-2,2-dimethyl-4-prop-2-enyl-1,3-dioxan-5-yl]methoxy]-dimethylsilane

C16H32O3Si — CID 11012044

IUPACtert-butyl-[[(4R,5R)-2,2-dimethyl-4-prop-2-enyl-1,3-dioxan-5-yl]methoxy]-dimethylsilane
SMILESC=CC[C@H]1OC(C)(C)OC[C@@H]1CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C16H32O3Si/c1-9-10-14-13(11-17-16(5,6)19-14)12-18-20(7,8)15(2,3)4/h9,13-14H,1,10-12H2,2-8H3/t13-,14-/m1/s1
InChIKeyFRYAYBWZTIFSMP-ZIAGYGMSSA-N
MW300.51 g/mol
LogP4.35
Rot. Bonds5

About tert-butyl-[[(4R,5R)-2,2-dimethyl-4-prop-2-enyl-1,3-dioxan-5-yl]methoxy]-dimethylsilane

tert-butyl-[[(4R,5R)-2,2-dimethyl-4-prop-2-enyl-1,3-dioxan-5-yl]methoxy]-dimethylsilane (PubChem CID 11012044) has the molecular formula C16H32O3Si and a molecular weight of 300.51 g/mol. Its IUPAC name is tert-butyl-[[(4R,5R)-2,2-dimethyl-4-prop-2-enyl-1,3-dioxan-5-yl]methoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[[(4R,5R)-2,2-dimethyl-4-prop-2-enyl-1,3-dioxan-5-yl]methoxy]-dimethylsilane
PubChem CID11012044
Molecular FormulaC16H32O3Si
Molecular Weight300.51 g/mol
Exact Mass300.21
IUPAC Nametert-butyl-[[(4R,5R)-2,2-dimethyl-4-prop-2-enyl-1,3-dioxan-5-yl]methoxy]-dimethylsilane
SMILESC=CC[C@H]1OC(C)(C)OC[C@@H]1CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C16H32O3Si/c1-9-10-14-13(11-17-16(5,6)19-14)12-18-20(7,8)15(2,3)4/h9,13-14H,1,10-12H2,2-8H3/t13-,14-/m1/s1
InChIKeyFRYAYBWZTIFSMP-ZIAGYGMSSA-N
XLogP4.35
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.51
LogP ≤ 54.35
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'}

Analyze tert-butyl-[[(4R,5R)-2,2-dimethyl-4-prop-2-enyl-1,3-dioxan-5-yl]methoxy]-dimethylsilane with MolForge

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Launch Full Analysis

Related Compounds

tert-butyl-[(3S,4R)-3-(methoxymethoxy)-4-methylhex-5-enoxy]-dimethylsilane
CID 15981704
tert-butyl-dimethyl-[(2S,3R)-3-methyl-1-(2-methyl-1,3-dioxolan-2-yl)pent-4-en-2-yl]oxysilane
CID 44220841
[(E,2S)-2-methyl-4-[(4S,5R)-2,2,5-trimethyl-1,3-dioxan-4-yl]pent-3-enoxy]-tri(propan-2-yl)silane
CID 134863672
[(E,2S)-2-methyl-4-[(4R,5R)-2,2,5-trimethyl-1,3-dioxan-4-yl]pent-3-enoxy]-tri(propan-2-yl)silane
CID 134863688
Tert-butyl-(3-ethenyloxan-4-yl)oxy-dimethylsilane
CID 58654193
tert-butyl-[(2R)-2-[(4S,6S)-2,2-dimethyl-6-prop-2-enyl-1,3-dioxan-4-yl]propoxy]-dimethylsilane
CID 10404268
tri(propan-2-yl)-[(1R)-1-[(4R,5S)-2,2,4-trimethyl-1,3-dioxan-5-yl]but-3-enoxy]silane
CID 10498503
[(1S)-1-[(4S,5S)-2,2-dimethyl-4-prop-2-enyl-1,3-dioxan-5-yl]but-3-enoxy]-tri(propan-2-yl)silane
CID 10500135
tert-butyl-[[(4S,5R)-2,2-dimethyl-5-prop-1-en-2-yl-1,3-dioxan-4-yl]methoxy]-dimethylsilane
CID 10542271
[(1S)-1-[(4R,5S)-2,2-dimethyl-4-prop-2-enyl-1,3-dioxan-5-yl]but-3-enoxy]-tri(propan-2-yl)silane
CID 10619947
tri(propan-2-yl)-[(1R)-1-[(4S,5S)-2,2,4-trimethyl-1,3-dioxan-5-yl]but-3-enoxy]silane
CID 10642035
[(1R)-1-[(4S,5S)-2,2-dimethyl-4-prop-2-enyl-1,3-dioxan-5-yl]but-3-enoxy]-tri(propan-2-yl)silane
CID 10643650

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[[(4R,5R)-2,2-dimethyl-4-prop-2-enyl-1,3-dioxan-5-yl]methoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[[(4R,5R)-2,2-dimethyl-4-prop-2-enyl-1,3-dioxan-5-yl]methoxy]-dimethylsilane (CID 11012044) is tert-butyl-[[(4R,5R)-2,2-dimethyl-4-prop-2-enyl-1,3-dioxan-5-yl]methoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[[(4R,5R)-2,2-dimethyl-4-prop-2-enyl-1,3-dioxan-5-yl]methoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[[(4R,5R)-2,2-dimethyl-4-prop-2-enyl-1,3-dioxan-5-yl]methoxy]-dimethylsilane is C=CC[C@H]1OC(C)(C)OC[C@@H]1CO[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-[[(4R,5R)-2,2-dimethyl-4-prop-2-enyl-1,3-dioxan-5-yl]methoxy]-dimethylsilane?
The InChIKey is FRYAYBWZTIFSMP-ZIAGYGMSSA-N. The full InChI is InChI=1S/C16H32O3Si/c1-9-10-14-13(11-17-16(5,6)19-14)12-18-20(7,8)15(2,3)4/h9,13-14H,1,10-12H2,2-8H3/t13-,14-/m1/s1.
What are the key properties of tert-butyl-[[(4R,5R)-2,2-dimethyl-4-prop-2-enyl-1,3-dioxan-5-yl]methoxy]-dimethylsilane?
tert-butyl-[[(4R,5R)-2,2-dimethyl-4-prop-2-enyl-1,3-dioxan-5-yl]methoxy]-dimethylsilane has a molecular weight of 300.51 g/mol, XLogP of 4.35, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[[(4R,5R)-2,2-dimethyl-4-prop-2-enyl-1,3-dioxan-5-yl]methoxy]-dimethylsilane is sourced from PubChem (CID 11012044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).