tert-butyl-[(4S,6S)-6-methoxy-8-methylnon-8-en-4-yl]oxy-dimethylsilane

C17H36O2Si — CID 25111168

IUPACtert-butyl-[(4S,6S)-6-methoxy-8-methylnon-8-en-4-yl]oxy-dimethylsilane
SMILESC=C(C)C[C@@H](C[C@H](CCC)O[Si](C)(C)C(C)(C)C)OC
InChIInChI=1S/C17H36O2Si/c1-10-11-15(13-16(18-7)12-14(2)3)19-20(8,9)17(4,5)6/h15-16H,2,10-13H2,1,3-9H3/t15-,16-/m0/s1
InChIKeyBKJILDSYCQBFQH-HOTGVXAUSA-N
MW300.56 g/mol
LogP5.55
Rot. Bonds9

About tert-butyl-[(4S,6S)-6-methoxy-8-methylnon-8-en-4-yl]oxy-dimethylsilane

tert-butyl-[(4S,6S)-6-methoxy-8-methylnon-8-en-4-yl]oxy-dimethylsilane (PubChem CID 25111168) has the molecular formula C17H36O2Si and a molecular weight of 300.56 g/mol. Its IUPAC name is tert-butyl-[(4S,6S)-6-methoxy-8-methylnon-8-en-4-yl]oxy-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[(4S,6S)-6-methoxy-8-methylnon-8-en-4-yl]oxy-dimethylsilane
PubChem CID25111168
Molecular FormulaC17H36O2Si
Molecular Weight300.56 g/mol
Exact Mass300.25
IUPAC Nametert-butyl-[(4S,6S)-6-methoxy-8-methylnon-8-en-4-yl]oxy-dimethylsilane
SMILESC=C(C)C[C@@H](C[C@H](CCC)O[Si](C)(C)C(C)(C)C)OC
InChIInChI=1S/C17H36O2Si/c1-10-11-15(13-16(18-7)12-14(2)3)19-20(8,9)17(4,5)6/h15-16H,2,10-13H2,1,3-9H3/t15-,16-/m0/s1
InChIKeyBKJILDSYCQBFQH-HOTGVXAUSA-N
XLogP5.55
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500300.56
LogP ≤ 55.55
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

tert-butyl-dimethyl-[(4R)-undec-1-en-4-yl]oxysilane
CID 10850655
tert-butyl-dimethyl-[(2R)-4-methylidene-1-[(2S)-oxiran-2-yl]hexan-2-yl]oxysilane
CID 11254249
tert-butyl-[(4R,6R)-4-[tert-butyl(dimethyl)silyl]oxynonadec-1-en-6-yl]oxy-dimethylsilane
CID 46180567
tert-butyl-dimethyl-[(4R)-non-1-en-4-yl]oxysilane
CID 101808240
tert-butyl-[(4R,6R)-6-[tert-butyl(dimethyl)silyl]oxynon-8-en-4-yl]oxy-dimethylsilane
CID 135014391
tert-butyl-dimethyl-[(4S)-undec-1-en-4-yl]oxysilane
CID 135038122
Triethyl-(12-methoxy-3-methylidenedodecyl)silane
CID 135061990
t-Butyldimethyl(10-octylundec-10-enyloxy)silane
CID 554936
Tert-butyl-dec-1-en-4-yloxy-dimethylsilane
CID 10825949
Diethyl-non-1-en-4-yloxy-prop-2-enylsilane
CID 140328618
tert-butyl-dimethyl-[(1R)-1-(2-trimethylsilyloxyprop-2-enyl)octoxy]silane
CID 142750055
tert-butyl-dimethyl-[(4S)-non-1-en-4-yl]oxysilane
CID 160766769

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[(4S,6S)-6-methoxy-8-methylnon-8-en-4-yl]oxy-dimethylsilane?
The IUPAC name of tert-butyl-[(4S,6S)-6-methoxy-8-methylnon-8-en-4-yl]oxy-dimethylsilane (CID 25111168) is tert-butyl-[(4S,6S)-6-methoxy-8-methylnon-8-en-4-yl]oxy-dimethylsilane.
What is the SMILES notation for tert-butyl-[(4S,6S)-6-methoxy-8-methylnon-8-en-4-yl]oxy-dimethylsilane?
The canonical SMILES for tert-butyl-[(4S,6S)-6-methoxy-8-methylnon-8-en-4-yl]oxy-dimethylsilane is C=C(C)C[C@@H](C[C@H](CCC)O[Si](C)(C)C(C)(C)C)OC.
What is the InChIKey of tert-butyl-[(4S,6S)-6-methoxy-8-methylnon-8-en-4-yl]oxy-dimethylsilane?
The InChIKey is BKJILDSYCQBFQH-HOTGVXAUSA-N. The full InChI is InChI=1S/C17H36O2Si/c1-10-11-15(13-16(18-7)12-14(2)3)19-20(8,9)17(4,5)6/h15-16H,2,10-13H2,1,3-9H3/t15-,16-/m0/s1.
What are the key properties of tert-butyl-[(4S,6S)-6-methoxy-8-methylnon-8-en-4-yl]oxy-dimethylsilane?
tert-butyl-[(4S,6S)-6-methoxy-8-methylnon-8-en-4-yl]oxy-dimethylsilane has a molecular weight of 300.56 g/mol, XLogP of 5.55, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(4S,6S)-6-methoxy-8-methylnon-8-en-4-yl]oxy-dimethylsilane is sourced from PubChem (CID 25111168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).