4-butylnon-4-en-1-ynyl(trimethyl)silane

C16H30Si — CID 71415263

IUPAC4-butylnon-4-en-1-ynyl(trimethyl)silane
SMILESCCCCC=C(CC#C[Si](C)(C)C)CCCC
InChIInChI=1S/C16H30Si/c1-6-8-10-13-16(12-9-7-2)14-11-15-17(3,4)5/h13H,6-10,12,14H2,1-5H3
InChIKeyNXXFJZWCLKGYRZ-UHFFFAOYSA-N
MW250.50 g/mol
LogP5.56
Rot. Bonds7

About 4-butylnon-4-en-1-ynyl(trimethyl)silane

4-butylnon-4-en-1-ynyl(trimethyl)silane (PubChem CID 71415263) has the molecular formula C16H30Si and a molecular weight of 250.50 g/mol. Its IUPAC name is 4-butylnon-4-en-1-ynyl(trimethyl)silane.

Molecular Properties

Compound Name4-butylnon-4-en-1-ynyl(trimethyl)silane
PubChem CID71415263
Molecular FormulaC16H30Si
Molecular Weight250.50 g/mol
Exact Mass250.21
IUPAC Name4-butylnon-4-en-1-ynyl(trimethyl)silane
SMILESCCCCC=C(CC#C[Si](C)(C)C)CCCC
InChIInChI=1S/C16H30Si/c1-6-8-10-13-16(12-9-7-2)14-11-15-17(3,4)5/h13H,6-10,12,14H2,1-5H3
InChIKeyNXXFJZWCLKGYRZ-UHFFFAOYSA-N
XLogP5.56
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500250.50
LogP ≤ 55.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

trimethyl(1-trimethylsilylundec-4-en-1-yn-4-yl)silane
CID 71415261
5-butyldec-5-ene
CID 15367252
[(4E)-4-benzylideneoct-1-ynyl]-trimethylsilane
CID 101369380
5,8-bis(trimethylsilyl)oct-4-en-7-yn-1-ol
CID 71441452
(Z)-6-ethylundec-5-ene
CID 102395453
5-ethyltetradec-5-ene
CID 54129215
(E)-12-bromo-6-butyldodec-5-ene
CID 10086325
5-butylicos-4-ene
CID 54084142
(E)-5-butyltridec-4-ene
CID 12531554
(Z)-5-ethyl-1-fluoronon-4-ene
CID 167034526
(Z)-1,5-bis(trimethylsilyl)dec-5-en-1-yn-3-ol
CID 134931746
(E)-5-(2-hexylsulfanylethyl)dec-5-ene
CID 134843827

Frequently Asked Questions

What is the IUPAC name of 4-butylnon-4-en-1-ynyl(trimethyl)silane?
The IUPAC name of 4-butylnon-4-en-1-ynyl(trimethyl)silane (CID 71415263) is 4-butylnon-4-en-1-ynyl(trimethyl)silane.
What is the SMILES notation for 4-butylnon-4-en-1-ynyl(trimethyl)silane?
The canonical SMILES for 4-butylnon-4-en-1-ynyl(trimethyl)silane is CCCCC=C(CC#C[Si](C)(C)C)CCCC.
What is the InChIKey of 4-butylnon-4-en-1-ynyl(trimethyl)silane?
The InChIKey is NXXFJZWCLKGYRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30Si/c1-6-8-10-13-16(12-9-7-2)14-11-15-17(3,4)5/h13H,6-10,12,14H2,1-5H3.
What are the key properties of 4-butylnon-4-en-1-ynyl(trimethyl)silane?
4-butylnon-4-en-1-ynyl(trimethyl)silane has a molecular weight of 250.50 g/mol, XLogP of 5.56, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-butylnon-4-en-1-ynyl(trimethyl)silane is sourced from PubChem (CID 71415263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).