tert-butyl-[(E)-11-[dimethyl(propyl)silyl]undec-10-enoxy]-dimethylsilane

C22H48OSi2 — CID 16680055

IUPACtert-butyl-[(E)-11-[dimethyl(propyl)silyl]undec-10-enoxy]-dimethylsilane
SMILESCCC[Si](C)(C)/C=C/CCCCCCCCCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C22H48OSi2/c1-9-20-24(5,6)21-18-16-14-12-10-11-13-15-17-19-23-25(7,8)22(2,3)4/h18,21H,9-17,19-20H2,1-8H3/b21-18+
InChIKeyBRRFBZZFGDFSAD-DYTRJAOYSA-N
MW384.80 g/mol
LogP8.34
Rot. Bonds14

About tert-butyl-[(E)-11-[dimethyl(propyl)silyl]undec-10-enoxy]-dimethylsilane

tert-butyl-[(E)-11-[dimethyl(propyl)silyl]undec-10-enoxy]-dimethylsilane (PubChem CID 16680055) has the molecular formula C22H48OSi2 and a molecular weight of 384.80 g/mol. Its IUPAC name is tert-butyl-[(E)-11-[dimethyl(propyl)silyl]undec-10-enoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[(E)-11-[dimethyl(propyl)silyl]undec-10-enoxy]-dimethylsilane
PubChem CID16680055
Molecular FormulaC22H48OSi2
Molecular Weight384.80 g/mol
Exact Mass384.32
IUPAC Nametert-butyl-[(E)-11-[dimethyl(propyl)silyl]undec-10-enoxy]-dimethylsilane
SMILESCCC[Si](C)(C)/C=C/CCCCCCCCCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C22H48OSi2/c1-9-20-24(5,6)21-18-16-14-12-10-11-13-15-17-19-23-25(7,8)22(2,3)4/h18,21H,9-17,19-20H2,1-8H3/b21-18+
InChIKeyBRRFBZZFGDFSAD-DYTRJAOYSA-N
XLogP8.34
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds14
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500384.80
LogP ≤ 58.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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(dec-9-enyloxy)dimethylsilane
CID 10869380
1-Nonen-3-ol, tert-butyldimethylsilyl ether
CID 10868924
Trimethyl(undec-10-enoxy)silane
CID 554429
1-Triethylsilyloxyundec-10-ene
CID 568575
Octadec-9Z-enol trimethylsilyl ether
CID 5366884
9-Decen-1-ol, TMS derivative
CID 12578077
Trimethyl(9-octadecenyloxy)-silane
CID 554435
Silane, (1,1-dimethylethyl)dimethyl(10-undecenyloxy)-
CID 10265922
tert-butyl-[(E)-dec-1-enoxy]-dimethylsilane
CID 11065530
Linoleyl alcohol tms ether
CID 15635192
11-(Dimethyldodecylsilyloxy)undec-1-ene
CID 531763
cis-9-octadecenol, tBDMS
CID 6430273

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[(E)-11-[dimethyl(propyl)silyl]undec-10-enoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[(E)-11-[dimethyl(propyl)silyl]undec-10-enoxy]-dimethylsilane (CID 16680055) is tert-butyl-[(E)-11-[dimethyl(propyl)silyl]undec-10-enoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[(E)-11-[dimethyl(propyl)silyl]undec-10-enoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[(E)-11-[dimethyl(propyl)silyl]undec-10-enoxy]-dimethylsilane is CCC[Si](C)(C)/C=C/CCCCCCCCCO[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-[(E)-11-[dimethyl(propyl)silyl]undec-10-enoxy]-dimethylsilane?
The InChIKey is BRRFBZZFGDFSAD-DYTRJAOYSA-N. The full InChI is InChI=1S/C22H48OSi2/c1-9-20-24(5,6)21-18-16-14-12-10-11-13-15-17-19-23-25(7,8)22(2,3)4/h18,21H,9-17,19-20H2,1-8H3/b21-18+.
What are the key properties of tert-butyl-[(E)-11-[dimethyl(propyl)silyl]undec-10-enoxy]-dimethylsilane?
tert-butyl-[(E)-11-[dimethyl(propyl)silyl]undec-10-enoxy]-dimethylsilane has a molecular weight of 384.80 g/mol, XLogP of 8.34, 14 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(E)-11-[dimethyl(propyl)silyl]undec-10-enoxy]-dimethylsilane is sourced from PubChem (CID 16680055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).