2,2-bis(trimethylsilyloxymethyl)oct-7-enoxy-trimethylsilane

C19H44O3Si3 — CID 140749420

IUPAC2,2-bis(trimethylsilyloxymethyl)oct-7-enoxy-trimethylsilane
SMILESC=CCCCCC(CO[Si](C)(C)C)(CO[Si](C)(C)C)CO[Si](C)(C)C
InChIInChI=1S/C19H44O3Si3/c1-11-12-13-14-15-19(16-20-23(2,3)4,17-21-24(5,6)7)18-22-25(8,9)10/h11H,1,12-18H2,2-10H3
InChIKeyWJYJVMWJVVBDMD-UHFFFAOYSA-N
MW404.82 g/mol
LogP6.27
Rot. Bonds14

About 2,2-bis(trimethylsilyloxymethyl)oct-7-enoxy-trimethylsilane

2,2-bis(trimethylsilyloxymethyl)oct-7-enoxy-trimethylsilane (PubChem CID 140749420) has the molecular formula C19H44O3Si3 and a molecular weight of 404.82 g/mol. Its IUPAC name is 2,2-bis(trimethylsilyloxymethyl)oct-7-enoxy-trimethylsilane.

Molecular Properties

Compound Name2,2-bis(trimethylsilyloxymethyl)oct-7-enoxy-trimethylsilane
PubChem CID140749420
Molecular FormulaC19H44O3Si3
Molecular Weight404.82 g/mol
Exact Mass404.26
IUPAC Name2,2-bis(trimethylsilyloxymethyl)oct-7-enoxy-trimethylsilane
SMILESC=CCCCCC(CO[Si](C)(C)C)(CO[Si](C)(C)C)CO[Si](C)(C)C
InChIInChI=1S/C19H44O3Si3/c1-11-12-13-14-15-19(16-20-23(2,3)4,17-21-24(5,6)7)18-22-25(8,9)10/h11H,1,12-18H2,2-10H3
InChIKeyWJYJVMWJVVBDMD-UHFFFAOYSA-N
XLogP6.27
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds14
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500404.82
LogP ≤ 56.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

trimethyl(2-trimethylsilyloxyoct-7-enoxy)silane
CID 15217373
2-(hydroxymethyl)-2-non-8-enylpropane-1,3-diol
CID 11521477
trimethyl-[(2E)-octa-2,7-dienoxy]silane
CID 22620662
tert-butyl-dimethyl-octadec-17-enoxysilane
CID 24879926
3-ethylundec-10-en-3-yloxysilane
CID 173196898
1,1-bis(trimethylsilyl)hex-5-enyl-trimethylsilane
CID 71440889
7-fluoro-7-methyloct-1-ene
CID 87159398
bis(hex-5-enyl)-methyl-trimethylsilyloxysilane
CID 22152516
ethoxy-hex-5-enyl-dimethylsilane
CID 87088698
6-[3-hex-5-enoxy-2,2-bis(hex-5-enoxymethyl)propoxy]hex-1-ene
CID 177402979
tert-butyl-[(2S)-2-[tert-butyl(dimethyl)silyl]oxyhept-6-enoxy]-dimethylsilane
CID 25001970
heptacosa-1,26-diene
CID 58905535

Frequently Asked Questions

What is the IUPAC name of 2,2-bis(trimethylsilyloxymethyl)oct-7-enoxy-trimethylsilane?
The IUPAC name of 2,2-bis(trimethylsilyloxymethyl)oct-7-enoxy-trimethylsilane (CID 140749420) is 2,2-bis(trimethylsilyloxymethyl)oct-7-enoxy-trimethylsilane.
What is the SMILES notation for 2,2-bis(trimethylsilyloxymethyl)oct-7-enoxy-trimethylsilane?
The canonical SMILES for 2,2-bis(trimethylsilyloxymethyl)oct-7-enoxy-trimethylsilane is C=CCCCCC(CO[Si](C)(C)C)(CO[Si](C)(C)C)CO[Si](C)(C)C.
What is the InChIKey of 2,2-bis(trimethylsilyloxymethyl)oct-7-enoxy-trimethylsilane?
The InChIKey is WJYJVMWJVVBDMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H44O3Si3/c1-11-12-13-14-15-19(16-20-23(2,3)4,17-21-24(5,6)7)18-22-25(8,9)10/h11H,1,12-18H2,2-10H3.
What are the key properties of 2,2-bis(trimethylsilyloxymethyl)oct-7-enoxy-trimethylsilane?
2,2-bis(trimethylsilyloxymethyl)oct-7-enoxy-trimethylsilane has a molecular weight of 404.82 g/mol, XLogP of 6.27, 14 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-bis(trimethylsilyloxymethyl)oct-7-enoxy-trimethylsilane is sourced from PubChem (CID 140749420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).