[(E)-3-diethylboranyldec-3-en-4-yl]-ethyl-dimethylsilane

C18H39BSi — CID 134903605

IUPAC[(E)-3-diethylboranyldec-3-en-4-yl]-ethyl-dimethylsilane
SMILESCCCCCC/C(=C(\CC)B(CC)CC)[Si](C)(C)CC
InChIInChI=1S/C18H39BSi/c1-8-13-14-15-16-18(20(6,7)12-5)17(9-2)19(10-3)11-4/h8-16H2,1-7H3/b18-17-
InChIKeyAQMRBFHCYCVQPX-ZCXUNETKSA-N
MW294.41 g/mol
LogP7.00
Rot. Bonds11

About [(E)-3-diethylboranyldec-3-en-4-yl]-ethyl-dimethylsilane

[(E)-3-diethylboranyldec-3-en-4-yl]-ethyl-dimethylsilane (PubChem CID 134903605) has the molecular formula C18H39BSi and a molecular weight of 294.41 g/mol. Its IUPAC name is [(E)-3-diethylboranyldec-3-en-4-yl]-ethyl-dimethylsilane.

Molecular Properties

Compound Name[(E)-3-diethylboranyldec-3-en-4-yl]-ethyl-dimethylsilane
PubChem CID134903605
Molecular FormulaC18H39BSi
Molecular Weight294.41 g/mol
Exact Mass294.29
IUPAC Name[(E)-3-diethylboranyldec-3-en-4-yl]-ethyl-dimethylsilane
SMILESCCCCCC/C(=C(\CC)B(CC)CC)[Si](C)(C)CC
InChIInChI=1S/C18H39BSi/c1-8-13-14-15-16-18(20(6,7)12-5)17(9-2)19(10-3)11-4/h8-16H2,1-7H3/b18-17-
InChIKeyAQMRBFHCYCVQPX-ZCXUNETKSA-N
XLogP7.00
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds11
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500294.41
LogP ≤ 57.00
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'}

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Related Compounds

[(E)-3-diethylboranyldec-3-en-4-yl]-trimethylsilane
CID 14436726
trimethyl-[(E)-tetradec-7-en-7-yl]silane
CID 12513012
trimethyl-[(Z)-tetradec-7-en-7-yl]silane
CID 12513013
trimethyl-[[trimethylsilylmethyl-[(Z)-1-trimethylsilyl-3-(trimethylsilylmethyl)oct-2-en-2-yl]boranyl]methyl]silane
CID 13761816
(e)-8-Diethylboryl-6-trimethylsilyl-dec-6-ene
CID 129828639
(2-Methylcyclohexen-1-yl)-tri(propan-2-yl)silane
CID 134877705
trimethyl-[(1Z)-2-trimethylsilylcycloundecen-1-yl]silane
CID 10709079

Frequently Asked Questions

What is the IUPAC name of [(E)-3-diethylboranyldec-3-en-4-yl]-ethyl-dimethylsilane?
The IUPAC name of [(E)-3-diethylboranyldec-3-en-4-yl]-ethyl-dimethylsilane (CID 134903605) is [(E)-3-diethylboranyldec-3-en-4-yl]-ethyl-dimethylsilane.
What is the SMILES notation for [(E)-3-diethylboranyldec-3-en-4-yl]-ethyl-dimethylsilane?
The canonical SMILES for [(E)-3-diethylboranyldec-3-en-4-yl]-ethyl-dimethylsilane is CCCCCC/C(=C(\CC)B(CC)CC)[Si](C)(C)CC.
What is the InChIKey of [(E)-3-diethylboranyldec-3-en-4-yl]-ethyl-dimethylsilane?
The InChIKey is AQMRBFHCYCVQPX-ZCXUNETKSA-N. The full InChI is InChI=1S/C18H39BSi/c1-8-13-14-15-16-18(20(6,7)12-5)17(9-2)19(10-3)11-4/h8-16H2,1-7H3/b18-17-.
What are the key properties of [(E)-3-diethylboranyldec-3-en-4-yl]-ethyl-dimethylsilane?
[(E)-3-diethylboranyldec-3-en-4-yl]-ethyl-dimethylsilane has a molecular weight of 294.41 g/mol, XLogP of 7.00, 11 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-3-diethylboranyldec-3-en-4-yl]-ethyl-dimethylsilane is sourced from PubChem (CID 134903605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).