tert-butyl-[(Z)-dec-3-en-1-yn-5-yl]oxy-dimethylsilane

C16H30OSi — CID 146163106

IUPACtert-butyl-[(Z)-dec-3-en-1-yn-5-yl]oxy-dimethylsilane
SMILESC#C/C=C\C(CCCCC)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C16H30OSi/c1-8-10-12-14-15(13-11-9-2)17-18(6,7)16(3,4)5/h2,11,13,15H,8,10,12,14H2,1,3-7H3/b13-11-
InChIKeyLWNGQVYWLWWKIL-QBFSEMIESA-N
MW266.50 g/mol
LogP5.15
Rot. Bonds7

About tert-butyl-[(Z)-dec-3-en-1-yn-5-yl]oxy-dimethylsilane

tert-butyl-[(Z)-dec-3-en-1-yn-5-yl]oxy-dimethylsilane (PubChem CID 146163106) has the molecular formula C16H30OSi and a molecular weight of 266.50 g/mol. Its IUPAC name is tert-butyl-[(Z)-dec-3-en-1-yn-5-yl]oxy-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[(Z)-dec-3-en-1-yn-5-yl]oxy-dimethylsilane
PubChem CID146163106
Molecular FormulaC16H30OSi
Molecular Weight266.50 g/mol
Exact Mass266.21
IUPAC Nametert-butyl-[(Z)-dec-3-en-1-yn-5-yl]oxy-dimethylsilane
SMILESC#C/C=C\C(CCCCC)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C16H30OSi/c1-8-10-12-14-15(13-11-9-2)17-18(6,7)16(3,4)5/h2,11,13,15H,8,10,12,14H2,1,3-7H3/b13-11-
InChIKeyLWNGQVYWLWWKIL-QBFSEMIESA-N
XLogP5.15
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500266.50
LogP ≤ 55.15
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': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

tert-Butyl(cyclohex-2-enyloxy)dimethylsilane
CID 11085130
Cyclohept-2-en-1-yloxy(trimethyl)silane
CID 12504316
tert-butyl-[(E)-henicos-8-en-6-yn-11-yl]oxy-dimethylsilane
CID 11247187
tert-butyl-[(3Z,5S,7Z)-deca-3,7-dien-1-yn-5-yl]oxy-dimethylsilane
CID 53359090
tert-butyl-[(E,3R)-hept-4-en-6-yn-3-yl]oxy-dimethylsilane
CID 122377729
tert-butyl-dimethyl-[(Z)-octadec-9-en-6-yl]oxysilane
CID 134866255
1-(Cyclohexen-1-yl)but-3-ynoxy-triethylsilane
CID 135023459
tert-butyl-dimethyl-[(E,6R)-undec-4-en-1-yn-6-yl]oxysilane
CID 138967347
tert-butyl-dimethyl-[(E,6R)-1-trimethylsilylundec-4-en-1-yn-6-yl]oxysilane
CID 138967662
tert-butyl-dimethyl-[(3E,5S,8Z)-undeca-3,8-dien-1-yn-5-yl]oxysilane
CID 138977425
tert-butyl-[(E,3S)-hept-4-en-6-yn-3-yl]oxy-dimethylsilane
CID 138982535
Tert-butyl-dimethyl-(5-methylidenedec-9-en-1-yn-4-yloxy)silane
CID 139252755

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[(Z)-dec-3-en-1-yn-5-yl]oxy-dimethylsilane?
The IUPAC name of tert-butyl-[(Z)-dec-3-en-1-yn-5-yl]oxy-dimethylsilane (CID 146163106) is tert-butyl-[(Z)-dec-3-en-1-yn-5-yl]oxy-dimethylsilane.
What is the SMILES notation for tert-butyl-[(Z)-dec-3-en-1-yn-5-yl]oxy-dimethylsilane?
The canonical SMILES for tert-butyl-[(Z)-dec-3-en-1-yn-5-yl]oxy-dimethylsilane is C#C/C=C\C(CCCCC)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-[(Z)-dec-3-en-1-yn-5-yl]oxy-dimethylsilane?
The InChIKey is LWNGQVYWLWWKIL-QBFSEMIESA-N. The full InChI is InChI=1S/C16H30OSi/c1-8-10-12-14-15(13-11-9-2)17-18(6,7)16(3,4)5/h2,11,13,15H,8,10,12,14H2,1,3-7H3/b13-11-.
What are the key properties of tert-butyl-[(Z)-dec-3-en-1-yn-5-yl]oxy-dimethylsilane?
tert-butyl-[(Z)-dec-3-en-1-yn-5-yl]oxy-dimethylsilane has a molecular weight of 266.50 g/mol, XLogP of 5.15, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(Z)-dec-3-en-1-yn-5-yl]oxy-dimethylsilane is sourced from PubChem (CID 146163106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).