2-Pentene, 3-diethylboryl-2-(methyl-1-propynylsilyl)-

C13H24BSi — CID 6329565

IUPAC
SMILESCC#C[Si](C)/C(C)=C(\CC)B(CC)CC
InChIInChI=1S/C13H24BSi/c1-7-11-15(6)12(5)13(8-2)14(9-3)10-4/h8-10H2,1-6H3/b13-12+
InChIKeyOVFFTFVMXVIKFT-OUKQBFOZSA-N
MW219.23 g/mol
LogP4.01
Rot. Bonds5

About 2-Pentene, 3-diethylboryl-2-(methyl-1-propynylsilyl)-

2-Pentene, 3-diethylboryl-2-(methyl-1-propynylsilyl)- (PubChem CID 6329565) has the molecular formula C13H24BSi and a molecular weight of 219.23 g/mol.

Molecular Properties

Compound Name2-Pentene, 3-diethylboryl-2-(methyl-1-propynylsilyl)-
PubChem CID6329565
Molecular FormulaC13H24BSi
Molecular Weight219.23 g/mol
Exact Mass219.17
IUPAC Name
SMILESCC#C[Si](C)/C(C)=C(\CC)B(CC)CC
InChIInChI=1S/C13H24BSi/c1-7-11-15(6)12(5)13(8-2)14(9-3)10-4/h8-10H2,1-6H3/b13-12+
InChIKeyOVFFTFVMXVIKFT-OUKQBFOZSA-N
XLogP4.01
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.23
LogP ≤ 54.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-Pentene, 3-diethylboryl-2-(methyl-1-propynylsilyl)-?
The IUPAC name of 2-Pentene, 3-diethylboryl-2-(methyl-1-propynylsilyl)- (CID 6329565) is not available.
What is the SMILES notation for 2-Pentene, 3-diethylboryl-2-(methyl-1-propynylsilyl)-?
The canonical SMILES for 2-Pentene, 3-diethylboryl-2-(methyl-1-propynylsilyl)- is CC#C[Si](C)/C(C)=C(\CC)B(CC)CC.
What is the InChIKey of 2-Pentene, 3-diethylboryl-2-(methyl-1-propynylsilyl)-?
The InChIKey is OVFFTFVMXVIKFT-OUKQBFOZSA-N. The full InChI is InChI=1S/C13H24BSi/c1-7-11-15(6)12(5)13(8-2)14(9-3)10-4/h8-10H2,1-6H3/b13-12+.
What are the key properties of 2-Pentene, 3-diethylboryl-2-(methyl-1-propynylsilyl)-?
2-Pentene, 3-diethylboryl-2-(methyl-1-propynylsilyl)- has a molecular weight of 219.23 g/mol, XLogP of 4.01, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-Pentene, 3-diethylboryl-2-(methyl-1-propynylsilyl)- is sourced from PubChem (CID 6329565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).