tert-butyl-[(2S)-2-methoxy-4-methylpent-4-enoxy]-dimethylsilane

C13H28O2Si — CID 16726469

IUPACtert-butyl-[(2S)-2-methoxy-4-methylpent-4-enoxy]-dimethylsilane
SMILESC=C(C)C[C@@H](CO[Si](C)(C)C(C)(C)C)OC
InChIInChI=1S/C13H28O2Si/c1-11(2)9-12(14-6)10-15-16(7,8)13(3,4)5/h12H,1,9-10H2,2-8H3/t12-/m0/s1
InChIKeyGKYDJAWYEBBAIQ-LBPRGKRZSA-N
MW244.45 g/mol
LogP3.99
Rot. Bonds6

About tert-butyl-[(2S)-2-methoxy-4-methylpent-4-enoxy]-dimethylsilane

tert-butyl-[(2S)-2-methoxy-4-methylpent-4-enoxy]-dimethylsilane (PubChem CID 16726469) has the molecular formula C13H28O2Si and a molecular weight of 244.45 g/mol. Its IUPAC name is tert-butyl-[(2S)-2-methoxy-4-methylpent-4-enoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[(2S)-2-methoxy-4-methylpent-4-enoxy]-dimethylsilane
PubChem CID16726469
Molecular FormulaC13H28O2Si
Molecular Weight244.45 g/mol
Exact Mass244.19
IUPAC Nametert-butyl-[(2S)-2-methoxy-4-methylpent-4-enoxy]-dimethylsilane
SMILESC=C(C)C[C@@H](CO[Si](C)(C)C(C)(C)C)OC
InChIInChI=1S/C13H28O2Si/c1-11(2)9-12(14-6)10-15-16(7,8)13(3,4)5/h12H,1,9-10H2,2-8H3/t12-/m0/s1
InChIKeyGKYDJAWYEBBAIQ-LBPRGKRZSA-N
XLogP3.99
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.45
LogP ≤ 53.99
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-[(3-prop-1-en-2-yloxiran-2-yl)methoxy]silane
CID 73115515
tert-butyl-dimethyl-[(1S)-1-[(2S)-oxiran-2-yl]but-3-enoxy]silane
CID 134963399
tert-butyl-[(2R)-2-methoxypent-4-enoxy]-dimethylsilane
CID 24806490
Trimethoxy-[3-(4-methylpent-4-en-2-yloxy)propyl]silane
CID 88723007
tert-butyl-dimethyl-[(3S)-5-methylideneheptan-3-yl]oxysilane
CID 89408189
4,5-Dimethoxy-2-methylpent-1-ene
CID 123601184
tert-butyl-[(2R)-4-iodo-2-methoxypent-4-enoxy]-dimethylsilane
CID 124001230
Hydroxy-dimethyl-[2-methyl-1-(4-methylpent-4-en-2-yloxy)propyl]silane
CID 10680996
Hydroxy-dimethyl-[1-(4-methylpent-4-en-2-yloxy)hexyl]silane
CID 10777637
tert-butyl-[(1R,2R)-2-methoxy-4-methylidenecyclohexyl]oxy-dimethylsilane
CID 10901260
[(4R)-4,5-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methylidenepentyl]-trimethylsilane
CID 11165972
tert-butyl-dimethyl-[[(2S,3R)-3-prop-1-en-2-yloxiran-2-yl]methoxy]silane
CID 11817043

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[(2S)-2-methoxy-4-methylpent-4-enoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[(2S)-2-methoxy-4-methylpent-4-enoxy]-dimethylsilane (CID 16726469) is tert-butyl-[(2S)-2-methoxy-4-methylpent-4-enoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[(2S)-2-methoxy-4-methylpent-4-enoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[(2S)-2-methoxy-4-methylpent-4-enoxy]-dimethylsilane is C=C(C)C[C@@H](CO[Si](C)(C)C(C)(C)C)OC.
What is the InChIKey of tert-butyl-[(2S)-2-methoxy-4-methylpent-4-enoxy]-dimethylsilane?
The InChIKey is GKYDJAWYEBBAIQ-LBPRGKRZSA-N. The full InChI is InChI=1S/C13H28O2Si/c1-11(2)9-12(14-6)10-15-16(7,8)13(3,4)5/h12H,1,9-10H2,2-8H3/t12-/m0/s1.
What are the key properties of tert-butyl-[(2S)-2-methoxy-4-methylpent-4-enoxy]-dimethylsilane?
tert-butyl-[(2S)-2-methoxy-4-methylpent-4-enoxy]-dimethylsilane has a molecular weight of 244.45 g/mol, XLogP of 3.99, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(2S)-2-methoxy-4-methylpent-4-enoxy]-dimethylsilane is sourced from PubChem (CID 16726469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).