trimethyl-[(E,3R,4R,6R,7R,8R)-2,4,6,8-tetramethyl-7-trimethylsilyloxyundec-9-en-3-yl]oxysilane

C21H46O2Si2 — CID 10810218

IUPACtrimethyl-[(E,3R,4R,6R,7R,8R)-2,4,6,8-tetramethyl-7-trimethylsilyloxyundec-9-en-3-yl]oxysilane
SMILESC/C=C/[C@@H](C)[C@H](O[Si](C)(C)C)[C@H](C)C[C@@H](C)[C@H](O[Si](C)(C)C)C(C)C
InChIInChI=1S/C21H46O2Si2/c1-13-14-17(4)21(23-25(10,11)12)19(6)15-18(5)20(16(2)3)22-24(7,8)9/h13-14,16-21H,15H2,1-12H3/b14-13+/t17-,18-,19-,20-,21+/m1/s1
InChIKeyPFXMPCPCQXZWIQ-MVLGCVPUSA-N
MW386.77 g/mol
LogP6.96
Rot. Bonds11

About trimethyl-[(E,3R,4R,6R,7R,8R)-2,4,6,8-tetramethyl-7-trimethylsilyloxyundec-9-en-3-yl]oxysilane

trimethyl-[(E,3R,4R,6R,7R,8R)-2,4,6,8-tetramethyl-7-trimethylsilyloxyundec-9-en-3-yl]oxysilane (PubChem CID 10810218) has the molecular formula C21H46O2Si2 and a molecular weight of 386.77 g/mol. Its IUPAC name is trimethyl-[(E,3R,4R,6R,7R,8R)-2,4,6,8-tetramethyl-7-trimethylsilyloxyundec-9-en-3-yl]oxysilane.

Molecular Properties

Compound Nametrimethyl-[(E,3R,4R,6R,7R,8R)-2,4,6,8-tetramethyl-7-trimethylsilyloxyundec-9-en-3-yl]oxysilane
PubChem CID10810218
Molecular FormulaC21H46O2Si2
Molecular Weight386.77 g/mol
Exact Mass386.30
IUPAC Nametrimethyl-[(E,3R,4R,6R,7R,8R)-2,4,6,8-tetramethyl-7-trimethylsilyloxyundec-9-en-3-yl]oxysilane
SMILESC/C=C/[C@@H](C)[C@H](O[Si](C)(C)C)[C@H](C)C[C@@H](C)[C@H](O[Si](C)(C)C)C(C)C
InChIInChI=1S/C21H46O2Si2/c1-13-14-17(4)21(23-25(10,11)12)19(6)15-18(5)20(16(2)3)22-24(7,8)9/h13-14,16-21H,15H2,1-12H3/b14-13+/t17-,18-,19-,20-,21+/m1/s1
InChIKeyPFXMPCPCQXZWIQ-MVLGCVPUSA-N
XLogP6.96
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500386.77
LogP ≤ 56.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

7,12-Bis(trimethylsiloxy)octadec-9-ene
CID 91341822
tert-butyl-dimethyl-[(3S,4R)-2-methyl-4-(2-methylprop-1-enyl)octan-3-yl]oxysilane
CID 11045214
tert-butyl-dimethyl-[(5S,6R)-6-(2-methylprop-1-enyl)decan-5-yl]oxysilane
CID 11077915
tert-butyl-[(1S)-1-[(1R,2E)-cycloundec-2-en-1-yl]but-3-ynoxy]-dimethylsilane
CID 11232927
[(2E,12R,13S)-13-bicyclo[10.2.1]pentadeca-1(15),2-dienyl]oxy-tert-butyl-dimethylsilane
CID 11302087
tert-butyl-[(Z,2R,6S)-6-[tert-butyl(dimethyl)silyl]oxyheptadec-8-en-2-yl]oxy-dimethylsilane
CID 25258171
[(3R,4R)-3-but-3-enyl-4-[tert-butyl(dimethyl)silyl]oxycyclohexen-1-yl]oxy-trimethylsilane
CID 134837952
tert-butyl-[1-[(2E)-cycloundec-2-en-1-yl]but-3-ynoxy]-dimethylsilane
CID 134887179
triethyl-[[(3R,6R)-3-[(1R)-1-triethylsilyloxyethyl]-1,2,3,4,5,6-hexahydroazulen-6-yl]methoxy]silane
CID 134940845
tert-butyl-dimethyl-[(3S,4S)-2-methyl-4-(2-methylprop-1-enyl)octan-3-yl]oxysilane
CID 134979489
[(2E)-13-bicyclo[10.2.1]pentadeca-1(15),2-dienyl]oxy-tert-butyl-dimethylsilane
CID 134982478
trimethyl-[(1R,2S)-2-[(E)-3-trimethylsilylbut-1-enyl]cyclohexyl]oxysilane
CID 135067882

Frequently Asked Questions

What is the IUPAC name of trimethyl-[(E,3R,4R,6R,7R,8R)-2,4,6,8-tetramethyl-7-trimethylsilyloxyundec-9-en-3-yl]oxysilane?
The IUPAC name of trimethyl-[(E,3R,4R,6R,7R,8R)-2,4,6,8-tetramethyl-7-trimethylsilyloxyundec-9-en-3-yl]oxysilane (CID 10810218) is trimethyl-[(E,3R,4R,6R,7R,8R)-2,4,6,8-tetramethyl-7-trimethylsilyloxyundec-9-en-3-yl]oxysilane.
What is the SMILES notation for trimethyl-[(E,3R,4R,6R,7R,8R)-2,4,6,8-tetramethyl-7-trimethylsilyloxyundec-9-en-3-yl]oxysilane?
The canonical SMILES for trimethyl-[(E,3R,4R,6R,7R,8R)-2,4,6,8-tetramethyl-7-trimethylsilyloxyundec-9-en-3-yl]oxysilane is C/C=C/[C@@H](C)[C@H](O[Si](C)(C)C)[C@H](C)C[C@@H](C)[C@H](O[Si](C)(C)C)C(C)C.
What is the InChIKey of trimethyl-[(E,3R,4R,6R,7R,8R)-2,4,6,8-tetramethyl-7-trimethylsilyloxyundec-9-en-3-yl]oxysilane?
The InChIKey is PFXMPCPCQXZWIQ-MVLGCVPUSA-N. The full InChI is InChI=1S/C21H46O2Si2/c1-13-14-17(4)21(23-25(10,11)12)19(6)15-18(5)20(16(2)3)22-24(7,8)9/h13-14,16-21H,15H2,1-12H3/b14-13+/t17-,18-,19-,20-,21+/m1/s1.
What are the key properties of trimethyl-[(E,3R,4R,6R,7R,8R)-2,4,6,8-tetramethyl-7-trimethylsilyloxyundec-9-en-3-yl]oxysilane?
trimethyl-[(E,3R,4R,6R,7R,8R)-2,4,6,8-tetramethyl-7-trimethylsilyloxyundec-9-en-3-yl]oxysilane has a molecular weight of 386.77 g/mol, XLogP of 6.96, 11 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(E,3R,4R,6R,7R,8R)-2,4,6,8-tetramethyl-7-trimethylsilyloxyundec-9-en-3-yl]oxysilane is sourced from PubChem (CID 10810218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).