trimethyl-[2-methylidene-4-[2-tri(propan-2-yl)silyloxyethynyl]heptyl]silane

C22H44OSi2 — CID 11474488

IUPACtrimethyl-[2-methylidene-4-[2-tri(propan-2-yl)silyloxyethynyl]heptyl]silane
SMILESC=C(CC(C#CO[Si](C(C)C)(C(C)C)C(C)C)CCC)C[Si](C)(C)C
InChIInChI=1S/C22H44OSi2/c1-12-13-22(16-21(8)17-24(9,10)11)14-15-23-25(18(2)3,19(4)5)20(6)7/h18-20,22H,8,12-13,16-17H2,1-7,9-11H3
InChIKeyJWWJJNJHWQLGBS-UHFFFAOYSA-N
MW380.77 g/mol
LogP7.84
Rot. Bonds10

About trimethyl-[2-methylidene-4-[2-tri(propan-2-yl)silyloxyethynyl]heptyl]silane

trimethyl-[2-methylidene-4-[2-tri(propan-2-yl)silyloxyethynyl]heptyl]silane (PubChem CID 11474488) has the molecular formula C22H44OSi2 and a molecular weight of 380.77 g/mol. Its IUPAC name is trimethyl-[2-methylidene-4-[2-tri(propan-2-yl)silyloxyethynyl]heptyl]silane.

Molecular Properties

Compound Nametrimethyl-[2-methylidene-4-[2-tri(propan-2-yl)silyloxyethynyl]heptyl]silane
PubChem CID11474488
Molecular FormulaC22H44OSi2
Molecular Weight380.77 g/mol
Exact Mass380.29
IUPAC Nametrimethyl-[2-methylidene-4-[2-tri(propan-2-yl)silyloxyethynyl]heptyl]silane
SMILESC=C(CC(C#CO[Si](C(C)C)(C(C)C)C(C)C)CCC)C[Si](C)(C)C
InChIInChI=1S/C22H44OSi2/c1-12-13-22(16-21(8)17-24(9,10)11)14-15-23-25(18(2)3,19(4)5)20(6)7/h18-20,22H,8,12-13,16-17H2,1-7,9-11H3
InChIKeyJWWJJNJHWQLGBS-UHFFFAOYSA-N
XLogP7.84
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500380.77
LogP ≤ 57.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

tri(propan-2-yl)-[(3S)-3-prop-2-enylhept-1-ynoxy]silane
CID 10968867
4-(2-Methylidenecyclopentyl)but-1-ynoxy-tri(propan-2-yl)silane
CID 11324238
[3-Methyl-3-(2-methylprop-2-enyl)oct-7-en-1-ynoxy]-tri(propan-2-yl)silane
CID 11405343
[(5-Methyl-3-propylhex-5-en-1-yn-1-yl)oxy]tri(propan-2-yl)silane
CID 71403487
[3-Methyl-3-(2-methylprop-2-enyl)oct-1-ynoxy]-tri(propan-2-yl)silane
CID 101352755
Triethyl-[5-(2-trimethylsilylethynyl)nona-1,8-dien-5-yloxy]silane
CID 10617884
Triethyl-[5-(3-methylbut-1-ynyl)nona-1,8-dien-5-yloxy]silane
CID 10734507
[(E)-5-methyl-3-propylhept-5-en-1-ynoxy]-tri(propan-2-yl)silane
CID 11427268
[(5-Methyl-3-propylhept-5-en-1-yn-1-yl)oxy]tri(propan-2-yl)silane
CID 71403205
tri(propan-2-yl)-[(3R,4R)-3,4,5-trimethylhex-5-en-1-ynoxy]silane
CID 101352754
3,5-Dimethylhex-5-en-1-ynoxy-tri(propan-2-yl)silane
CID 102289114
tert-butyl-dimethyl-[(6R)-6-prop-1-en-2-yldeca-1,2-dien-8-yn-3-yl]oxysilane
CID 102486594

Frequently Asked Questions

What is the IUPAC name of trimethyl-[2-methylidene-4-[2-tri(propan-2-yl)silyloxyethynyl]heptyl]silane?
The IUPAC name of trimethyl-[2-methylidene-4-[2-tri(propan-2-yl)silyloxyethynyl]heptyl]silane (CID 11474488) is trimethyl-[2-methylidene-4-[2-tri(propan-2-yl)silyloxyethynyl]heptyl]silane.
What is the SMILES notation for trimethyl-[2-methylidene-4-[2-tri(propan-2-yl)silyloxyethynyl]heptyl]silane?
The canonical SMILES for trimethyl-[2-methylidene-4-[2-tri(propan-2-yl)silyloxyethynyl]heptyl]silane is C=C(CC(C#CO[Si](C(C)C)(C(C)C)C(C)C)CCC)C[Si](C)(C)C.
What is the InChIKey of trimethyl-[2-methylidene-4-[2-tri(propan-2-yl)silyloxyethynyl]heptyl]silane?
The InChIKey is JWWJJNJHWQLGBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H44OSi2/c1-12-13-22(16-21(8)17-24(9,10)11)14-15-23-25(18(2)3,19(4)5)20(6)7/h18-20,22H,8,12-13,16-17H2,1-7,9-11H3.
What are the key properties of trimethyl-[2-methylidene-4-[2-tri(propan-2-yl)silyloxyethynyl]heptyl]silane?
trimethyl-[2-methylidene-4-[2-tri(propan-2-yl)silyloxyethynyl]heptyl]silane has a molecular weight of 380.77 g/mol, XLogP of 7.84, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[2-methylidene-4-[2-tri(propan-2-yl)silyloxyethynyl]heptyl]silane is sourced from PubChem (CID 11474488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).