tert-butyl-dimethyl-[3-[(1S)-1-prop-2-enoxyethyl]penta-1,4-dien-3-yloxy]silane

C16H30O2Si — CID 10708071

IUPACtert-butyl-dimethyl-[3-[(1S)-1-prop-2-enoxyethyl]penta-1,4-dien-3-yloxy]silane
SMILESC=CCO[C@@H](C)C(C=C)(C=C)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C16H30O2Si/c1-10-13-17-14(4)16(11-2,12-3)18-19(8,9)15(5,6)7/h10-12,14H,1-3,13H2,4-9H3/t14-/m0/s1
InChIKeyRNVARBBHIHXWGU-AWEZNQCLSA-N
MW282.50 g/mol
LogP4.71
Rot. Bonds8

About tert-butyl-dimethyl-[3-[(1S)-1-prop-2-enoxyethyl]penta-1,4-dien-3-yloxy]silane

tert-butyl-dimethyl-[3-[(1S)-1-prop-2-enoxyethyl]penta-1,4-dien-3-yloxy]silane (PubChem CID 10708071) has the molecular formula C16H30O2Si and a molecular weight of 282.50 g/mol. Its IUPAC name is tert-butyl-dimethyl-[3-[(1S)-1-prop-2-enoxyethyl]penta-1,4-dien-3-yloxy]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[3-[(1S)-1-prop-2-enoxyethyl]penta-1,4-dien-3-yloxy]silane
PubChem CID10708071
Molecular FormulaC16H30O2Si
Molecular Weight282.50 g/mol
Exact Mass282.20
IUPAC Nametert-butyl-dimethyl-[3-[(1S)-1-prop-2-enoxyethyl]penta-1,4-dien-3-yloxy]silane
SMILESC=CCO[C@@H](C)C(C=C)(C=C)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C16H30O2Si/c1-10-13-17-14(4)16(11-2,12-3)18-19(8,9)15(5,6)7/h10-12,14H,1-3,13H2,4-9H3/t14-/m0/s1
InChIKeyRNVARBBHIHXWGU-AWEZNQCLSA-N
XLogP4.71
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.50
LogP ≤ 54.71
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-[[(2S,3S)-3-ethenyl-2-methyl-2,6-dihydropyran-3-yl]oxy]-dimethylsilane
CID 10824866
tert-butyl-[[(2S,3S)-3-ethenyl-2-methyloxiran-2-yl]methoxy]-dimethylsilane
CID 11160538
tert-butyl-dimethyl-[(2S,3R)-3-[(3R)-2-methylpent-1-en-3-yl]oxyhex-5-en-2-yl]oxysilane
CID 11551386
Tert-butyl-[(3-ethenyloxiran-2-yl)methoxy]-dimethylsilane
CID 72750800
tert-butyl-[[(2S,3R)-3-ethenyl-2-methyl-2,6-dihydropyran-3-yl]oxy]-dimethylsilane
CID 101083171
tert-butyl-dimethyl-[(3R,4R)-4-prop-2-enoxyhexa-1,5-dien-3-yl]oxysilane
CID 102183142
trimethyl-[[(3R,4R)-4-prop-2-enoxyhexa-1,5-dien-3-yl]oxy-bis(trimethylsilyl)silyl]silane
CID 134854197
tert-butyl-dimethyl-[(3S,4S)-3-methyl-4-(3-methylbut-2-enoxy)pent-1-en-3-yl]oxysilane
CID 134960946
tert-butyl-[[(2R,3R)-3-ethenyloxiran-2-yl]methoxy]-dimethylsilane
CID 11206675
Tert-butyl-[2-(2-methoxybut-3-enoxy)ethoxy]-dimethylsilane
CID 58406057
Tert-butyl [(2-methoxy-2-methylpent-4-en-1-yl)oxy]dimethylsilane
CID 59271891
tert-butyl-[[(2R,3S)-3-ethenyloxiran-2-yl]methoxy]-dimethylsilane
CID 59482156

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[3-[(1S)-1-prop-2-enoxyethyl]penta-1,4-dien-3-yloxy]silane?
The IUPAC name of tert-butyl-dimethyl-[3-[(1S)-1-prop-2-enoxyethyl]penta-1,4-dien-3-yloxy]silane (CID 10708071) is tert-butyl-dimethyl-[3-[(1S)-1-prop-2-enoxyethyl]penta-1,4-dien-3-yloxy]silane.
What is the SMILES notation for tert-butyl-dimethyl-[3-[(1S)-1-prop-2-enoxyethyl]penta-1,4-dien-3-yloxy]silane?
The canonical SMILES for tert-butyl-dimethyl-[3-[(1S)-1-prop-2-enoxyethyl]penta-1,4-dien-3-yloxy]silane is C=CCO[C@@H](C)C(C=C)(C=C)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-dimethyl-[3-[(1S)-1-prop-2-enoxyethyl]penta-1,4-dien-3-yloxy]silane?
The InChIKey is RNVARBBHIHXWGU-AWEZNQCLSA-N. The full InChI is InChI=1S/C16H30O2Si/c1-10-13-17-14(4)16(11-2,12-3)18-19(8,9)15(5,6)7/h10-12,14H,1-3,13H2,4-9H3/t14-/m0/s1.
What are the key properties of tert-butyl-dimethyl-[3-[(1S)-1-prop-2-enoxyethyl]penta-1,4-dien-3-yloxy]silane?
tert-butyl-dimethyl-[3-[(1S)-1-prop-2-enoxyethyl]penta-1,4-dien-3-yloxy]silane has a molecular weight of 282.50 g/mol, XLogP of 4.71, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[3-[(1S)-1-prop-2-enoxyethyl]penta-1,4-dien-3-yloxy]silane is sourced from PubChem (CID 10708071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).