(6-methoxy-3,5-dimethyl-2-phenyl-3,6-dihydro-2H-pyran-4-yl)oxy-trimethylsilane

C17H26O3Si — CID 13084979

IUPAC(6-methoxy-3,5-dimethyl-2-phenyl-3,6-dihydro-2H-pyran-4-yl)oxy-trimethylsilane
SMILESCOC1OC(c2ccccc2)C(C)C(O[Si](C)(C)C)=C1C
InChIInChI=1S/C17H26O3Si/c1-12-15(20-21(4,5)6)13(2)17(18-3)19-16(12)14-10-8-7-9-11-14/h7-12,16-17H,1-6H3
InChIKeyUPQBODAWTFPVCR-UHFFFAOYSA-N
MW306.48 g/mol
LogP4.49
Rot. Bonds4

About (6-methoxy-3,5-dimethyl-2-phenyl-3,6-dihydro-2H-pyran-4-yl)oxy-trimethylsilane

(6-methoxy-3,5-dimethyl-2-phenyl-3,6-dihydro-2H-pyran-4-yl)oxy-trimethylsilane (PubChem CID 13084979) has the molecular formula C17H26O3Si and a molecular weight of 306.48 g/mol. Its IUPAC name is (6-methoxy-3,5-dimethyl-2-phenyl-3,6-dihydro-2H-pyran-4-yl)oxy-trimethylsilane.

Molecular Properties

Compound Name(6-methoxy-3,5-dimethyl-2-phenyl-3,6-dihydro-2H-pyran-4-yl)oxy-trimethylsilane
PubChem CID13084979
Molecular FormulaC17H26O3Si
Molecular Weight306.48 g/mol
Exact Mass306.17
IUPAC Name(6-methoxy-3,5-dimethyl-2-phenyl-3,6-dihydro-2H-pyran-4-yl)oxy-trimethylsilane
SMILESCOC1OC(c2ccccc2)C(C)C(O[Si](C)(C)C)=C1C
InChIInChI=1S/C17H26O3Si/c1-12-15(20-21(4,5)6)13(2)17(18-3)19-16(12)14-10-8-7-9-11-14/h7-12,16-17H,1-6H3
InChIKeyUPQBODAWTFPVCR-UHFFFAOYSA-N
XLogP4.49
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.48
LogP ≤ 54.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

(Diethoxymethyl)benzene
CID 69884
2,5,5-Trimethyl-2-phenyl-1,3-dioxane
CID 79409
4-Phenyl-1,3-dioxane
CID 92840
1,3-Dioxane, 2,4,6-trimethyl-4-phenyl-
CID 107381
2,4,6-Triphenyl-1,3-dioxane
CID 568919
4,4,6-Trimethyl-2-phenyl-1,3-dioxane
CID 95632
1,3-Dioxane, 5,5-dimethyl-2-phenyl-
CID 69895
4-Methyl-2-phenyl-1,3-dioxane
CID 95393
1,3-Dioxane, 4,4-dimethyl-2,6-diphenyl-
CID 53425980
Benzene, 1,1'-(ethylidenebis(oxymethylene))bis-
CID 90160
Acetophenone diethyl ketal
CID 138187
(Dibutoxymethyl)benzene
CID 219171

Frequently Asked Questions

What is the IUPAC name of (6-methoxy-3,5-dimethyl-2-phenyl-3,6-dihydro-2H-pyran-4-yl)oxy-trimethylsilane?
The IUPAC name of (6-methoxy-3,5-dimethyl-2-phenyl-3,6-dihydro-2H-pyran-4-yl)oxy-trimethylsilane (CID 13084979) is (6-methoxy-3,5-dimethyl-2-phenyl-3,6-dihydro-2H-pyran-4-yl)oxy-trimethylsilane.
What is the SMILES notation for (6-methoxy-3,5-dimethyl-2-phenyl-3,6-dihydro-2H-pyran-4-yl)oxy-trimethylsilane?
The canonical SMILES for (6-methoxy-3,5-dimethyl-2-phenyl-3,6-dihydro-2H-pyran-4-yl)oxy-trimethylsilane is COC1OC(c2ccccc2)C(C)C(O[Si](C)(C)C)=C1C.
What is the InChIKey of (6-methoxy-3,5-dimethyl-2-phenyl-3,6-dihydro-2H-pyran-4-yl)oxy-trimethylsilane?
The InChIKey is UPQBODAWTFPVCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26O3Si/c1-12-15(20-21(4,5)6)13(2)17(18-3)19-16(12)14-10-8-7-9-11-14/h7-12,16-17H,1-6H3.
What are the key properties of (6-methoxy-3,5-dimethyl-2-phenyl-3,6-dihydro-2H-pyran-4-yl)oxy-trimethylsilane?
(6-methoxy-3,5-dimethyl-2-phenyl-3,6-dihydro-2H-pyran-4-yl)oxy-trimethylsilane has a molecular weight of 306.48 g/mol, XLogP of 4.49, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6-methoxy-3,5-dimethyl-2-phenyl-3,6-dihydro-2H-pyran-4-yl)oxy-trimethylsilane is sourced from PubChem (CID 13084979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).