tert-butyl-dimethyl-[3-(4-methyl-5-methylidene-2H-pyran-2-yl)propoxy]silane

C16H30O2Si — CID 11208333

IUPACtert-butyl-dimethyl-[3-(4-methyl-5-methylidene-2H-pyran-2-yl)propoxy]silane
SMILESC=C1COC(CCCO[Si](C)(C)C(C)(C)C)C=C1C
InChIInChI=1S/C16H30O2Si/c1-13-11-15(17-12-14(13)2)9-8-10-18-19(6,7)16(3,4)5/h11,15H,2,8-10,12H2,1,3-7H3
InChIKeyPMNHWBWDKWDOCA-UHFFFAOYSA-N
MW282.50 g/mol
LogP4.69
Rot. Bonds5

About tert-butyl-dimethyl-[3-(4-methyl-5-methylidene-2H-pyran-2-yl)propoxy]silane

tert-butyl-dimethyl-[3-(4-methyl-5-methylidene-2H-pyran-2-yl)propoxy]silane (PubChem CID 11208333) has the molecular formula C16H30O2Si and a molecular weight of 282.50 g/mol. Its IUPAC name is tert-butyl-dimethyl-[3-(4-methyl-5-methylidene-2H-pyran-2-yl)propoxy]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[3-(4-methyl-5-methylidene-2H-pyran-2-yl)propoxy]silane
PubChem CID11208333
Molecular FormulaC16H30O2Si
Molecular Weight282.50 g/mol
Exact Mass282.20
IUPAC Nametert-butyl-dimethyl-[3-(4-methyl-5-methylidene-2H-pyran-2-yl)propoxy]silane
SMILESC=C1COC(CCCO[Si](C)(C)C(C)(C)C)C=C1C
InChIInChI=1S/C16H30O2Si/c1-13-11-15(17-12-14(13)2)9-8-10-18-19(6,7)16(3,4)5/h11,15H,2,8-10,12H2,1,3-7H3
InChIKeyPMNHWBWDKWDOCA-UHFFFAOYSA-N
XLogP4.69
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.50
LogP ≤ 54.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

tert-butyl-[(E,2S)-4-[(2R,6R)-6-ethyl-5-methyl-3,6-dihydro-2H-pyran-2-yl]-2-methylpent-3-enoxy]-dimethylsilane
CID 16115684
Tert-butyl-dimethyl-(1,3,6,7-tetrahydro-2-benzofuran-5-yloxy)silane
CID 134863497
tert-butyl-[(E)-6-(3,4-dihydro-2H-pyran-6-yl)hex-5-enoxy]-dimethylsilane
CID 139254024
[2-(Ethoxymethyl)cyclohexa-1,3-dien-1-yl]oxy-triethylsilane
CID 176427842
2,2,4-Trimethyl-3-[2-dimethyl(tert-butyl)silyloxyethyl]-6-ethenyl-5,6-dihydropyrane
CID 554486
6-Methyl-4-trimethylsilylmethyl-5,6-dihydro-2H-pyran
CID 13493655
tert-butyl-dimethyl-[2-(5-methyl-3,6-dihydro-2H-pyran-2-yl)ethoxy]silane
CID 21986090
butyl-dimethyl-[2-(5-methyl-3,6-dihydro-2H-pyran-2-yl)ethoxy]silane
CID 69572108
(1-Butoxy-2-methylcyclohexa-2,4-dien-1-yl)-cyclopenta-1,3-dien-1-yl-dimethylsilane
CID 70017508
dimethyl-[2-(5-methyl-3,6-dihydro-2H-pyran-2-yl)ethoxy]silane
CID 173185534
tert-butyl-dimethyl-[[(2R)-2-prop-1-en-2-yl-3,6-dihydro-2H-pyran-3-yl]oxy]silane
CID 173852787
tert-butyl-dimethyl-[3-[(2R,6R)-2-propyl-3,6-dihydro-2H-pyran-6-yl]propoxy]silane
CID 11055638

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[3-(4-methyl-5-methylidene-2H-pyran-2-yl)propoxy]silane?
The IUPAC name of tert-butyl-dimethyl-[3-(4-methyl-5-methylidene-2H-pyran-2-yl)propoxy]silane (CID 11208333) is tert-butyl-dimethyl-[3-(4-methyl-5-methylidene-2H-pyran-2-yl)propoxy]silane.
What is the SMILES notation for tert-butyl-dimethyl-[3-(4-methyl-5-methylidene-2H-pyran-2-yl)propoxy]silane?
The canonical SMILES for tert-butyl-dimethyl-[3-(4-methyl-5-methylidene-2H-pyran-2-yl)propoxy]silane is C=C1COC(CCCO[Si](C)(C)C(C)(C)C)C=C1C.
What is the InChIKey of tert-butyl-dimethyl-[3-(4-methyl-5-methylidene-2H-pyran-2-yl)propoxy]silane?
The InChIKey is PMNHWBWDKWDOCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30O2Si/c1-13-11-15(17-12-14(13)2)9-8-10-18-19(6,7)16(3,4)5/h11,15H,2,8-10,12H2,1,3-7H3.
What are the key properties of tert-butyl-dimethyl-[3-(4-methyl-5-methylidene-2H-pyran-2-yl)propoxy]silane?
tert-butyl-dimethyl-[3-(4-methyl-5-methylidene-2H-pyran-2-yl)propoxy]silane has a molecular weight of 282.50 g/mol, XLogP of 4.69, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[3-(4-methyl-5-methylidene-2H-pyran-2-yl)propoxy]silane is sourced from PubChem (CID 11208333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).