trimethyl-(2-propyl-3-trimethylsilyldodec-11-enoxy)silane

C21H46OSi2 — CID 20725103

IUPACtrimethyl-(2-propyl-3-trimethylsilyldodec-11-enoxy)silane
SMILESC=CCCCCCCCC(C(CCC)CO[Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C21H46OSi2/c1-9-11-12-13-14-15-16-18-21(23(3,4)5)20(17-10-2)19-22-24(6,7)8/h9,20-21H,1,10-19H2,2-8H3
InChIKeyRMOCEIQCEXAMRB-UHFFFAOYSA-N
MW370.77 g/mol
LogP7.88
Rot. Bonds15

About trimethyl-(2-propyl-3-trimethylsilyldodec-11-enoxy)silane

trimethyl-(2-propyl-3-trimethylsilyldodec-11-enoxy)silane (PubChem CID 20725103) has the molecular formula C21H46OSi2 and a molecular weight of 370.77 g/mol. Its IUPAC name is trimethyl-(2-propyl-3-trimethylsilyldodec-11-enoxy)silane.

Molecular Properties

Compound Nametrimethyl-(2-propyl-3-trimethylsilyldodec-11-enoxy)silane
PubChem CID20725103
Molecular FormulaC21H46OSi2
Molecular Weight370.77 g/mol
Exact Mass370.31
IUPAC Nametrimethyl-(2-propyl-3-trimethylsilyldodec-11-enoxy)silane
SMILESC=CCCCCCCCC(C(CCC)CO[Si](C)(C)C)[Si](C)(C)C
InChIInChI=1S/C21H46OSi2/c1-9-11-12-13-14-15-16-18-21(23(3,4)5)20(17-10-2)19-22-24(6,7)8/h9,20-21H,1,10-19H2,2-8H3
InChIKeyRMOCEIQCEXAMRB-UHFFFAOYSA-N
XLogP7.88
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds15
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500370.77
LogP ≤ 57.88
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'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

Tert-butyl(dec-9-enyloxy)dimethylsilane
CID 10869380
1-Triethylsilyloxyundec-10-ene
CID 568575
Silane, (1,1-dimethylethyl)dimethyl(10-undecenyloxy)-
CID 10265922
11-(Dimethyldodecylsilyloxy)undec-1-ene
CID 531763
1-Triisopropylsilyloxy-10-undecene
CID 535044
Tert-butyl-(8-cyclohex-3-en-1-yloctoxy)-dimethylsilane
CID 11313354
tert-butyl-[(2R)-2-ethenyloctoxy]-dimethylsilane
CID 11818090
tert-butyl-[(E)-11-[dimethyl(propyl)silyl]undec-10-enoxy]-dimethylsilane
CID 16680055
Tert-butyl-dimethyl-(9-methyl-9-prop-2-enyldodec-11-enoxy)silane
CID 46185276
tert-butyl-[(2S)-2-ethenyloctoxy]-dimethylsilane
CID 102331827
[(E)-3-cyclohexyl-3-trimethylsilyloxyprop-1-enyl]-tri(propan-2-yl)silane
CID 134883124
tert-butyl-[(3R,4S)-4-ethenyl-2-methyloctan-3-yl]oxy-dimethylsilane
CID 134980552

Frequently Asked Questions

What is the IUPAC name of trimethyl-(2-propyl-3-trimethylsilyldodec-11-enoxy)silane?
The IUPAC name of trimethyl-(2-propyl-3-trimethylsilyldodec-11-enoxy)silane (CID 20725103) is trimethyl-(2-propyl-3-trimethylsilyldodec-11-enoxy)silane.
What is the SMILES notation for trimethyl-(2-propyl-3-trimethylsilyldodec-11-enoxy)silane?
The canonical SMILES for trimethyl-(2-propyl-3-trimethylsilyldodec-11-enoxy)silane is C=CCCCCCCCC(C(CCC)CO[Si](C)(C)C)[Si](C)(C)C.
What is the InChIKey of trimethyl-(2-propyl-3-trimethylsilyldodec-11-enoxy)silane?
The InChIKey is RMOCEIQCEXAMRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H46OSi2/c1-9-11-12-13-14-15-16-18-21(23(3,4)5)20(17-10-2)19-22-24(6,7)8/h9,20-21H,1,10-19H2,2-8H3.
What are the key properties of trimethyl-(2-propyl-3-trimethylsilyldodec-11-enoxy)silane?
trimethyl-(2-propyl-3-trimethylsilyldodec-11-enoxy)silane has a molecular weight of 370.77 g/mol, XLogP of 7.88, 15 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-(2-propyl-3-trimethylsilyldodec-11-enoxy)silane is sourced from PubChem (CID 20725103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).