trimethyl-[(E)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pent-4-en-1-ynyl]silane

C14H25BO2Si — CID 11054535

IUPACtrimethyl-[(E)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pent-4-en-1-ynyl]silane
SMILESCC1(C)OB(/C=C/CC#C[Si](C)(C)C)OC1(C)C
InChIInChI=1S/C14H25BO2Si/c1-13(2)14(3,4)17-15(16-13)11-9-8-10-12-18(5,6)7/h9,11H,8H2,1-7H3/b11-9+
InChIKeyCYUBHELBTAHLQE-PKNBQFBNSA-N
MW264.25 g/mol
LogP3.44
Rot. Bonds2

About trimethyl-[(E)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pent-4-en-1-ynyl]silane

trimethyl-[(E)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pent-4-en-1-ynyl]silane (PubChem CID 11054535) has the molecular formula C14H25BO2Si and a molecular weight of 264.25 g/mol. Its IUPAC name is trimethyl-[(E)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pent-4-en-1-ynyl]silane.

Molecular Properties

Compound Nametrimethyl-[(E)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pent-4-en-1-ynyl]silane
PubChem CID11054535
Molecular FormulaC14H25BO2Si
Molecular Weight264.25 g/mol
Exact Mass264.17
IUPAC Nametrimethyl-[(E)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pent-4-en-1-ynyl]silane
SMILESCC1(C)OB(/C=C/CC#C[Si](C)(C)C)OC1(C)C
InChIInChI=1S/C14H25BO2Si/c1-13(2)14(3,4)17-15(16-13)11-9-8-10-12-18(5,6)7/h9,11H,8H2,1-7H3/b11-9+
InChIKeyCYUBHELBTAHLQE-PKNBQFBNSA-N
XLogP3.44
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.25
LogP ≤ 53.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

trimethyl-[(Z)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pent-4-en-1-ynyl]silane
CID 10999910
2-(3-bromoprop-1-enyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CID 71332875
[(E)-hex-4-en-1-ynyl]-trimethylsilane
CID 23649692
2-[(E)-5-bromopent-1-enyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CID 167722175
(E)-N,N-dimethyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-en-1-amine
CID 67227822
2-[(E)-3-cyclopropylprop-1-enyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CID 140824914
2-[(E)-5-chloropent-1-enyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CID 11128132
tert-butyl-dimethyl-[(E)-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)prop-2-enoxy]silane
CID 10968526
4,4,5,5-tetramethyl-2-non-1-enyl-1,3,2-dioxaborolane
CID 86013616
[(4Z,7E)-8-iodoocta-4,7-dien-1-ynyl]-trimethylsilane
CID 58436116
2-[(Z)-3-(methoxymethoxy)prop-1-enyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CID 90117460
(E)-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethenol
CID 166102136

Frequently Asked Questions

What is the IUPAC name of trimethyl-[(E)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pent-4-en-1-ynyl]silane?
The IUPAC name of trimethyl-[(E)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pent-4-en-1-ynyl]silane (CID 11054535) is trimethyl-[(E)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pent-4-en-1-ynyl]silane.
What is the SMILES notation for trimethyl-[(E)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pent-4-en-1-ynyl]silane?
The canonical SMILES for trimethyl-[(E)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pent-4-en-1-ynyl]silane is CC1(C)OB(/C=C/CC#C[Si](C)(C)C)OC1(C)C.
What is the InChIKey of trimethyl-[(E)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pent-4-en-1-ynyl]silane?
The InChIKey is CYUBHELBTAHLQE-PKNBQFBNSA-N. The full InChI is InChI=1S/C14H25BO2Si/c1-13(2)14(3,4)17-15(16-13)11-9-8-10-12-18(5,6)7/h9,11H,8H2,1-7H3/b11-9+.
What are the key properties of trimethyl-[(E)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pent-4-en-1-ynyl]silane?
trimethyl-[(E)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pent-4-en-1-ynyl]silane has a molecular weight of 264.25 g/mol, XLogP of 3.44, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(E)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pent-4-en-1-ynyl]silane is sourced from PubChem (CID 11054535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).