dimethyl-[(1S)-1-[(2S)-pent-4-en-2-yl]oxyhexyl]-trimethylsilyloxysilane

C16H36O2Si2 — CID 10734226

IUPACdimethyl-[(1S)-1-[(2S)-pent-4-en-2-yl]oxyhexyl]-trimethylsilyloxysilane
SMILESC=CC[C@H](C)O[C@H](CCCCC)[Si](C)(C)O[Si](C)(C)C
InChIInChI=1S/C16H36O2Si2/c1-9-11-12-14-16(17-15(3)13-10-2)20(7,8)18-19(4,5)6/h10,15-16H,2,9,11-14H2,1,3-8H3/t15-,16-/m0/s1
InChIKeyPBKSJMJLYMXNED-HOTGVXAUSA-N
MW316.63 g/mol
LogP5.51
Rot. Bonds11

About dimethyl-[(1S)-1-[(2S)-pent-4-en-2-yl]oxyhexyl]-trimethylsilyloxysilane

dimethyl-[(1S)-1-[(2S)-pent-4-en-2-yl]oxyhexyl]-trimethylsilyloxysilane (PubChem CID 10734226) has the molecular formula C16H36O2Si2 and a molecular weight of 316.63 g/mol. Its IUPAC name is dimethyl-[(1S)-1-[(2S)-pent-4-en-2-yl]oxyhexyl]-trimethylsilyloxysilane.

Molecular Properties

Compound Namedimethyl-[(1S)-1-[(2S)-pent-4-en-2-yl]oxyhexyl]-trimethylsilyloxysilane
PubChem CID10734226
Molecular FormulaC16H36O2Si2
Molecular Weight316.63 g/mol
Exact Mass316.23
IUPAC Namedimethyl-[(1S)-1-[(2S)-pent-4-en-2-yl]oxyhexyl]-trimethylsilyloxysilane
SMILESC=CC[C@H](C)O[C@H](CCCCC)[Si](C)(C)O[Si](C)(C)C
InChIInChI=1S/C16H36O2Si2/c1-9-11-12-14-16(17-15(3)13-10-2)20(7,8)18-19(4,5)6/h10,15-16H,2,9,11-14H2,1,3-8H3/t15-,16-/m0/s1
InChIKeyPBKSJMJLYMXNED-HOTGVXAUSA-N
XLogP5.51
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500316.63
LogP ≤ 55.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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

1,3-bis[(1-Ethenylhexyl)oxy]-1,1,3,3-tetramethyldisiloxane
CID 91720811
bis[(1-Ethenylhexyl)oxy](dimethyl)silane
CID 91737719
3-Ethenoxyhex-5-enoxy-tri(propan-2-yl)silane
CID 11623558
triethyl-[(Z)-1-trimethylsilylnon-1-en-4-yl]oxysilane
CID 11953737
trimethyl-[(1R,3S)-1-prop-2-enyl-3-trimethylsilyloxyhex-5-enoxy]silane
CID 14106275
tert-butyl-[(4R,5R)-5-[tert-butyl(dimethyl)silyl]oxyocta-1,7-dien-4-yl]oxy-dimethylsilane
CID 15416504
tert-butyl-[(4R,6R)-4-[tert-butyl(dimethyl)silyl]oxynonadec-1-en-6-yl]oxy-dimethylsilane
CID 46180567
tert-butyl-[(2R,4R)-4-[tert-butyl(dimethyl)silyl]oxy-2-methoxyhept-6-enoxy]-dimethylsilane
CID 72948039
Dimethoxy-(7-methoxyheptyl)-oct-1-enylsilane
CID 91344794
tert-butyl-[(3S)-3-[tert-butyl(dimethyl)silyl]oxyhex-5-enoxy]-dimethylsilane
CID 134940445
tert-butyl-[(4R,6R)-6-[tert-butyl(dimethyl)silyl]oxynon-8-en-4-yl]oxy-dimethylsilane
CID 135014391
trimethyl-[(E)-1-[(2S)-oxetan-2-yl]-4-trimethylsilylbut-3-en-2-yl]silane
CID 135037289

Frequently Asked Questions

What is the IUPAC name of dimethyl-[(1S)-1-[(2S)-pent-4-en-2-yl]oxyhexyl]-trimethylsilyloxysilane?
The IUPAC name of dimethyl-[(1S)-1-[(2S)-pent-4-en-2-yl]oxyhexyl]-trimethylsilyloxysilane (CID 10734226) is dimethyl-[(1S)-1-[(2S)-pent-4-en-2-yl]oxyhexyl]-trimethylsilyloxysilane.
What is the SMILES notation for dimethyl-[(1S)-1-[(2S)-pent-4-en-2-yl]oxyhexyl]-trimethylsilyloxysilane?
The canonical SMILES for dimethyl-[(1S)-1-[(2S)-pent-4-en-2-yl]oxyhexyl]-trimethylsilyloxysilane is C=CC[C@H](C)O[C@H](CCCCC)[Si](C)(C)O[Si](C)(C)C.
What is the InChIKey of dimethyl-[(1S)-1-[(2S)-pent-4-en-2-yl]oxyhexyl]-trimethylsilyloxysilane?
The InChIKey is PBKSJMJLYMXNED-HOTGVXAUSA-N. The full InChI is InChI=1S/C16H36O2Si2/c1-9-11-12-14-16(17-15(3)13-10-2)20(7,8)18-19(4,5)6/h10,15-16H,2,9,11-14H2,1,3-8H3/t15-,16-/m0/s1.
What are the key properties of dimethyl-[(1S)-1-[(2S)-pent-4-en-2-yl]oxyhexyl]-trimethylsilyloxysilane?
dimethyl-[(1S)-1-[(2S)-pent-4-en-2-yl]oxyhexyl]-trimethylsilyloxysilane has a molecular weight of 316.63 g/mol, XLogP of 5.51, 11 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-[(1S)-1-[(2S)-pent-4-en-2-yl]oxyhexyl]-trimethylsilyloxysilane is sourced from PubChem (CID 10734226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).